Myristicin Details
:
IUPAC Name
4-methoxy-6-prop-2-enyl-1,3-benzodioxole
:Chemical Class
:CAS Registry Number
607-91-0
:Description
:Fragrance Type
balsamic
Physical and Chemical properties
| PUBCHEM ID | 4276 |
| Molecular Weight (g/mol) | 192.211 |
| Molecular Formula | C11H12O3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| IUPAC Name | 4-methoxy-6-prop-2-enyl-1,3-benzodioxole |
| Canonical SMILES | C=CCc2cc(OC)c1OCOc1c2 |
| PUBCHEM IUPAC INCHIKEY | BNWJOHGLIBDBOB-UHFFFAOYSA-N |
| Solubility Level | 3 |
| Vapour Pressure | -2.892 |
Absorption and Metabolism information
| XLOGP3 AA | |
| CACTVS TPSA | 27.7 |
| BBB Level | 1 |
| Absorption Level | 0 |
| EXT PPB#Prediction | 1 |
| AlogP98 | 2.589 |
| EXT CYP2D6#Prediction | 0 |
Toxicological Information
| Mouse Female FDA | Non-Carcinogen |
| Mouse Male FDA | Non-Carcinogen |
| Rat Female FDA | Non-Carcinogen |
| Rat Male FDA | Non-Carcinogen |
| Ames Prediction | Non-Mutagen |
| Developmental / Reproductive Toxicity | Non-Toxic |
| Rat Oral LD50 | 0.163606 g/kg_body_weight |
| Ocular Irritancy | Severe |
| Hepatotoxic#Prediction | 1 |
| Effected Human Genes |
Ecological Information
| Aerobic Biodegradability Prediction | Degradable |
Hazard(s) Identification
| Physical hazards | not classified |
| Health hazards | Moderate |
| Environmental hazards | not classified |
Compound Biological Activity
| Serial No. | Cas No | Gene Symbol | Organism | Interaction | Interaction Actions | PubMed Id |
|---|---|---|---|---|---|---|
| 1 | 607-91-0 | ABL1 | Homo sapiens | myristicin results in decreased expression of ABL1 mRNA | decreases^expression | 24792648 |
| 2 | 607-91-0 | ANKRD17 | Homo sapiens | myristicin results in decreased expression of ANKRD17 mRNA | decreases^expression | 24792648 |
| 3 | 607-91-0 | ATM | Homo sapiens | myristicin results in decreased expression of ATM mRNA | decreases^expression | 24792648 |
| 4 | 607-91-0 | BRCA1 | Homo sapiens | myristicin results in decreased expression of BRCA1 mRNA | decreases^expression | 24792648 |
| 5 | 607-91-0 | BTG2 | Homo sapiens | myristicin results in decreased expression of BTG2 mRNA | decreases^expression | 24792648 |
| 6 | 607-91-0 | CASP3 | Homo sapiens | myristicin results in increased activity of CASP3 protein | increases^activity | 24792648 |
| 7 | 607-91-0 | CDK7 | Homo sapiens | myristicin results in increased expression of CDK7 mRNA | increases^expression | 24792648 |
| 8 | 607-91-0 | CHEK2 | Homo sapiens | myristicin results in decreased expression of CHEK2 mRNA | decreases^expression | 24792648 |
| 9 | 607-91-0 | CYP1A1 | Mus musculus | myristicin results in increased expression of and results in increased activity of CYP1A1 protein | increases^activity|increases^expression | 9168900 |
| 10 | 607-91-0 | CYP1A1 | Mus musculus | myristicin results in increased expression of CYP1A1 mRNA | increases^expression | 9168900 |
| 11 | 607-91-0 | CYP1A2 | Homo sapiens | Glutathione inhibits the reaction [myristicin results in decreased activity of CYP1A2 protein] | decreases^activity|decreases^reaction | 26091900 |
| 12 | 607-91-0 | CYP1A2 | Homo sapiens | myristicin results in decreased activity of CYP1A2 protein | decreases^activity | 26091900 |
| 13 | 607-91-0 | DMC1 | Homo sapiens | myristicin results in decreased expression of DMC1 mRNA | decreases^expression | 24792648 |
| 14 | 607-91-0 | ERCC1 | Homo sapiens | myristicin results in decreased expression of ERCC1 mRNA | decreases^expression | 24792648 |
| 15 | 607-91-0 | ERCC2 | Homo sapiens | myristicin results in decreased expression of ERCC2 mRNA | decreases^expression | 24792648 |
| 16 | 607-91-0 | FEN1 | Homo sapiens | myristicin results in decreased expression of FEN1 mRNA | decreases^expression | 24792648 |
| 17 | 607-91-0 | GADD45A | Homo sapiens | myristicin results in decreased expression of GADD45A mRNA | decreases^expression | 24792648 |
| 18 | 607-91-0 | GADD45G | Homo sapiens | myristicin results in decreased expression of GADD45G mRNA | decreases^expression | 24792648 |
| 19 | 607-91-0 | GTF2H2 | Homo sapiens | myristicin results in decreased expression of GTF2H2 mRNA | decreases^expression | 24792648 |
| 20 | 607-91-0 | HUS1 | Homo sapiens | myristicin results in decreased expression of HUS1 mRNA | decreases^expression | 24792648 |
| 21 | 607-91-0 | IGHMBP2 | Homo sapiens | myristicin results in decreased expression of IGHMBP2 mRNA | decreases^expression | 24792648 |
| 22 | 607-91-0 | MAP3K20 | Homo sapiens | myristicin results in decreased expression of MAP3K20 mRNA | decreases^expression | 24792648 |
| 23 | 607-91-0 | MAPK12 | Homo sapiens | myristicin results in decreased expression of MAPK12 mRNA | decreases^expression | 24792648 |
| 24 | 607-91-0 | MLH3 | Homo sapiens | myristicin results in decreased expression of MLH3 mRNA | decreases^expression | 24792648 |
| 25 | 607-91-0 | MRE11 | Homo sapiens | myristicin results in decreased expression of MRE11 mRNA | decreases^expression | 24792648 |
| 26 | 607-91-0 | MSH3 | Homo sapiens | myristicin results in decreased expression of MSH3 mRNA | decreases^expression | 24792648 |
| 27 | 607-91-0 | MUTYH | Homo sapiens | myristicin results in decreased expression of MUTYH mRNA | decreases^expression | 24792648 |
| 28 | 607-91-0 | N4BP2 | Homo sapiens | myristicin results in decreased expression of N4BP2 mRNA | decreases^expression | 24792648 |
| 29 | 607-91-0 | NBN | Homo sapiens | myristicin results in decreased expression of NBN mRNA | decreases^expression | 24792648 |
| 30 | 607-91-0 | OGG1 | Homo sapiens | myristicin results in decreased expression of OGG1 mRNA | decreases^expression | 24792648 |
| 31 | 607-91-0 | PMS2 | Homo sapiens | myristicin results in decreased expression of PMS2 mRNA | decreases^expression | 24792648 |
| 32 | 607-91-0 | PNKP | Homo sapiens | myristicin results in decreased expression of PNKP mRNA | decreases^expression | 24792648 |
| 33 | 607-91-0 | PPP1R15A | Homo sapiens | myristicin results in decreased expression of PPP1R15A mRNA | decreases^expression | 24792648 |
| 34 | 607-91-0 | PRKDC | Homo sapiens | myristicin results in decreased expression of PRKDC mRNA | decreases^expression | 24792648 |
| 35 | 607-91-0 | RAD50 | Homo sapiens | myristicin results in decreased expression of RAD50 mRNA | decreases^expression | 24792648 |
| 36 | 607-91-0 | RAD51 | Homo sapiens | myristicin results in decreased expression of RAD51 mRNA | decreases^expression | 24792648 |
| 37 | 607-91-0 | RAD51B | Homo sapiens | myristicin results in decreased expression of RAD51B mRNA | decreases^expression | 24792648 |
| 38 | 607-91-0 | RAD9A | Homo sapiens | myristicin results in decreased expression of RAD9A mRNA | decreases^expression | 24792648 |
| 39 | 607-91-0 | REV1 | Homo sapiens | myristicin results in decreased expression of REV1 mRNA | decreases^expression | 24792648 |
| 40 | 607-91-0 | SESN1 | Homo sapiens | myristicin results in decreased expression of SESN1 mRNA | decreases^expression | 24792648 |
| 41 | 607-91-0 | SMC1A | Homo sapiens | myristicin results in decreased expression of SMC1A mRNA | decreases^expression | 24792648 |
| 42 | 607-91-0 | TP73 | Homo sapiens | myristicin results in decreased expression of TP73 mRNA | decreases^expression | 24792648 |
| 43 | 607-91-0 | TREX1 | Homo sapiens | myristicin results in decreased expression of TREX1 mRNA | decreases^expression | 24792648 |
| 44 | 607-91-0 | XRCC2 | Homo sapiens | myristicin results in decreased expression of XRCC2 mRNA | decreases^expression | 24792648 |
| 45 | 607-91-0 | XRCC3 | Homo sapiens | myristicin results in decreased expression of XRCC3 mRNA | decreases^expression | 24792648 |
| 46 | 607-91-0 | XRCC3 | Homo sapiens | myristicin results in increased expression of XRCC3 mRNA | increases^expression | 24792648 |
| 47 | 607-91-0 | ABL1 | Homo sapiens | myristicin results in decreased expression of ABL1 mRNA | decreases^expression | 24792648 |
| 48 | 607-91-0 | ANKRD17 | Homo sapiens | myristicin results in decreased expression of ANKRD17 mRNA | decreases^expression | 24792648 |
| 49 | 607-91-0 | ATM | Homo sapiens | myristicin results in decreased expression of ATM mRNA | decreases^expression | 24792648 |
| 50 | 607-91-0 | BRCA1 | Homo sapiens | myristicin results in decreased expression of BRCA1 mRNA | decreases^expression | 24792648 |
| 51 | 607-91-0 | BTG2 | Homo sapiens | myristicin results in decreased expression of BTG2 mRNA | decreases^expression | 24792648 |
| 52 | 607-91-0 | CASP3 | Homo sapiens | myristicin results in increased activity of CASP3 protein | increases^activity | 24792648 |
| 53 | 607-91-0 | CDK7 | Homo sapiens | myristicin results in increased expression of CDK7 mRNA | increases^expression | 24792648 |
| 54 | 607-91-0 | CHEK2 | Homo sapiens | myristicin results in decreased expression of CHEK2 mRNA | decreases^expression | 24792648 |
| 55 | 607-91-0 | CYP1A1 | Mus musculus | myristicin results in increased expression of and results in increased activity of CYP1A1 protein | increases^activity|increases^expression | 9168900 |
| 56 | 607-91-0 | CYP1A1 | Mus musculus | myristicin results in increased expression of CYP1A1 mRNA | increases^expression | 9168900 |
| 57 | 607-91-0 | CYP1A2 | Homo sapiens | Glutathione inhibits the reaction [myristicin results in decreased activity of CYP1A2 protein] | decreases^activity|decreases^reaction | 26091900 |
| 58 | 607-91-0 | CYP1A2 | Homo sapiens | myristicin results in decreased activity of CYP1A2 protein | decreases^activity | 26091900 |
| 59 | 607-91-0 | DMC1 | Homo sapiens | myristicin results in decreased expression of DMC1 mRNA | decreases^expression | 24792648 |
| 60 | 607-91-0 | ERCC1 | Homo sapiens | myristicin results in decreased expression of ERCC1 mRNA | decreases^expression | 24792648 |
| 61 | 607-91-0 | ERCC2 | Homo sapiens | myristicin results in decreased expression of ERCC2 mRNA | decreases^expression | 24792648 |
| 62 | 607-91-0 | FEN1 | Homo sapiens | myristicin results in decreased expression of FEN1 mRNA | decreases^expression | 24792648 |
| 63 | 607-91-0 | GADD45A | Homo sapiens | myristicin results in decreased expression of GADD45A mRNA | decreases^expression | 24792648 |
| 64 | 607-91-0 | GADD45G | Homo sapiens | myristicin results in decreased expression of GADD45G mRNA | decreases^expression | 24792648 |
| 65 | 607-91-0 | GTF2H2 | Homo sapiens | myristicin results in decreased expression of GTF2H2 mRNA | decreases^expression | 24792648 |
| 66 | 607-91-0 | HUS1 | Homo sapiens | myristicin results in decreased expression of HUS1 mRNA | decreases^expression | 24792648 |
| 67 | 607-91-0 | IGHMBP2 | Homo sapiens | myristicin results in decreased expression of IGHMBP2 mRNA | decreases^expression | 24792648 |
| 68 | 607-91-0 | MAP3K20 | Homo sapiens | myristicin results in decreased expression of MAP3K20 mRNA | decreases^expression | 24792648 |
| 69 | 607-91-0 | MAPK12 | Homo sapiens | myristicin results in decreased expression of MAPK12 mRNA | decreases^expression | 24792648 |
| 70 | 607-91-0 | MLH3 | Homo sapiens | myristicin results in decreased expression of MLH3 mRNA | decreases^expression | 24792648 |
| 71 | 607-91-0 | MRE11 | Homo sapiens | myristicin results in decreased expression of MRE11 mRNA | decreases^expression | 24792648 |
| 72 | 607-91-0 | MSH3 | Homo sapiens | myristicin results in decreased expression of MSH3 mRNA | decreases^expression | 24792648 |
| 73 | 607-91-0 | MUTYH | Homo sapiens | myristicin results in decreased expression of MUTYH mRNA | decreases^expression | 24792648 |
| 74 | 607-91-0 | N4BP2 | Homo sapiens | myristicin results in decreased expression of N4BP2 mRNA | decreases^expression | 24792648 |
| 75 | 607-91-0 | NBN | Homo sapiens | myristicin results in decreased expression of NBN mRNA | decreases^expression | 24792648 |
| 76 | 607-91-0 | OGG1 | Homo sapiens | myristicin results in decreased expression of OGG1 mRNA | decreases^expression | 24792648 |
| 77 | 607-91-0 | PMS2 | Homo sapiens | myristicin results in decreased expression of PMS2 mRNA | decreases^expression | 24792648 |
| 78 | 607-91-0 | PNKP | Homo sapiens | myristicin results in decreased expression of PNKP mRNA | decreases^expression | 24792648 |
| 79 | 607-91-0 | PPP1R15A | Homo sapiens | myristicin results in decreased expression of PPP1R15A mRNA | decreases^expression | 24792648 |
| 80 | 607-91-0 | PRKDC | Homo sapiens | myristicin results in decreased expression of PRKDC mRNA | decreases^expression | 24792648 |
| 81 | 607-91-0 | RAD50 | Homo sapiens | myristicin results in decreased expression of RAD50 mRNA | decreases^expression | 24792648 |
| 82 | 607-91-0 | RAD51 | Homo sapiens | myristicin results in decreased expression of RAD51 mRNA | decreases^expression | 24792648 |
| 83 | 607-91-0 | RAD51B | Homo sapiens | myristicin results in decreased expression of RAD51B mRNA | decreases^expression | 24792648 |
| 84 | 607-91-0 | RAD9A | Homo sapiens | myristicin results in decreased expression of RAD9A mRNA | decreases^expression | 24792648 |
| 85 | 607-91-0 | REV1 | Homo sapiens | myristicin results in decreased expression of REV1 mRNA | decreases^expression | 24792648 |
| 86 | 607-91-0 | SESN1 | Homo sapiens | myristicin results in decreased expression of SESN1 mRNA | decreases^expression | 24792648 |
| 87 | 607-91-0 | SMC1A | Homo sapiens | myristicin results in decreased expression of SMC1A mRNA | decreases^expression | 24792648 |
| 88 | 607-91-0 | TP73 | Homo sapiens | myristicin results in decreased expression of TP73 mRNA | decreases^expression | 24792648 |
| 89 | 607-91-0 | TREX1 | Homo sapiens | myristicin results in decreased expression of TREX1 mRNA | decreases^expression | 24792648 |
| 90 | 607-91-0 | XRCC2 | Homo sapiens | myristicin results in decreased expression of XRCC2 mRNA | decreases^expression | 24792648 |
| 91 | 607-91-0 | XRCC3 | Homo sapiens | myristicin results in decreased expression of XRCC3 mRNA | decreases^expression | 24792648 |
| 92 | 607-91-0 | XRCC3 | Homo sapiens | myristicin results in increased expression of XRCC3 mRNA | increases^expression | 24792648 |
| Serial No. | Activity Name | Details | References (PubMed) | Other details EPA (U.S) | Clinical Trials (U.S. NIH) |
|---|---|---|---|---|---|
| 1 | 607-91-0 | Myristicin |
Plant Variety and Essential oils
| Serial No. | Plant Name | Variety Name | Essential Oil | Compound Percentage |
|---|---|---|---|---|
| 1 | Gurmari | Gymnema sylvestre essential oil | ||
| 2 | Chaerophyllum villosum | Chaerophyllum villosum essential oil | ||
| 3 | Chaerophyllum villosum | Chaerophyllum villosum essential oil |
Compound Image
2D Structure
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