Cannabichromevarin
PubChem CID: 6451726
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| Compound Synonyms | CANNABICHROMEVARIN, Cannabivarichromene, 41408-19-9, Cbc-v, 57130-04-8, CBCV, 3Q9WSZ6RI4, UNII-3Q9WSZ6RI4, 2-methyl-2-(4-methylpent-3-enyl)-7-propylchromen-5-ol, (+/-)-Cannabichromevarin, 2H-1-Benzopyran-5-ol, 2-methyl-2-(4-methyl-3-penten-1-yl)-7-propyl-, (+)-, 2H-1-Benzopyran-5-ol, 2-methyl-2-(4-methyl-3-pentenyl)-7-propyl-, (+)-, 2-Methyl-2-(4-methylpent-3-en-1-yl)-7-propyl-2H-chromen-5-ol, 2-methyl-2-(4-methyl-3-penten-1-yl)-7-propyl-2H-1-benzopyran-5-ol, SCHEMBL13214113, SCHEMBL21348201, DTXSID20961664, CHEBI:228766, (+/-)-Cannabichromevarin (CRM), (+/-)-Cannabichromevarin (CBCV), 2H-1-Benzopyran-5-ol, 2-methyl-2-(4-methyl-3-pentenyl)-7-propyl-, BC177464, DB-321902, NS00097766, Q27257900, Cannabichromevarin (CBCV) 100 microg/mL in Acetonitrile, Cannabichromevarin (CBCV) 1000 microg/mL in Acetonitrile, (+)-2-METHYL-2-(4-METHYL-3-PENTENYL)-7-PROPYL-2H-1-BENZOPYRAN-5-OL |
|---|---|
| Ghose Rule | True |
| Classyfire Kingdom | Organic compounds |
| Topological Polar Surface Area | 29.5 |
| Hydrogen Bond Donor Count | 1.0 |
| Pfizer 3 75 Rule | False |
| Scaffold Graph Level | C1CCC2CCCCC2C1 |
| Np Classifier Class | Cannabinoids |
| Deep Smiles | CCCcccOCC)CCC=CC)C)))))C=Cc6cc%10)O |
| Heavy Atom Count | 21.0 |
| Classyfire Class | Benzopyrans |
| Scaffold Graph Node Level | C1CCC2OCCCC2C1 |
| Classyfire Subclass | 1-benzopyrans |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 394.0 |
| Database Name | imppat_phytochem;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 2-methyl-2-(4-methylpent-3-enyl)-7-propylchromen-5-ol |
| Veber Rule | True |
| Classyfire Superclass | Organoheterocyclic compounds |
| Xlogp | 5.8 |
| Gsk 4 400 Rule | False |
| Molecular Formula | C19H26O2 |
| Scaffold Graph Node Bond Level | C1=Cc2ccccc2OC1 |
| Inchi Key | AAXZFUQLLRMVOG-UHFFFAOYSA-N |
| Silicos It Class | Moderately soluble |
| Rotatable Bond Count | 5.0 |
| Synonyms | cannabivarichromene |
| Esol Class | Moderately soluble |
| Functional Groups | CC=C(C)C, cC=CC, cO, cOC |
| Compound Name | Cannabichromevarin |
| Exact Mass | 286.193 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 286.193 |
| Hydrogen Bond Acceptor Count | 2.0 |
| Molecular Weight | 286.4 |
| Gi Absorption | True |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 1.0 |
| Total Bond Stereocenter Count | 0.0 |
| Lipinski Rule Of 5 | True |
| Inchi | InChI=1S/C19H26O2/c1-5-7-15-12-17(20)16-9-11-19(4,21-18(16)13-15)10-6-8-14(2)3/h8-9,11-13,20H,5-7,10H2,1-4H3 |
| Smiles | CCCC1=CC(=C2C=CC(OC2=C1)(C)CCC=C(C)C)O |
| Np Classifier Biosynthetic Pathway | Terpenoids |
| Defined Bond Stereocenter Count | 0.0 |
| Egan Rule | True |
| Np Classifier Superclass | Meroterpenoids |
- 1. Outgoing r'ship
FOUND_INto/from Cannabis Sativa (Plant) Rel Props:Reference:ISBN:9788185042084