| Phytochemical Name : Cannabidiolic acid |
| PCNDIDC0028 |
| Pubchem CID : 160570 |
| Molecular formula: C22H30O4 |
| Canonical SMILES : CCCCCC1=CC(=C(C(=C1C(=O)O)O)C2C=C(CCC2C(=C)C)C)O |
Synonymes : Cannabidiolic acid|1244-58-2|Cannabidiol Acid|CBDA|FJX8O3OJCD|UNII-FJX8O3OJCD|CHEBI:3359|2,4-dihydroxy-3-[(1R,6R)-3-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-6-pentylbenzoic acid|3-p-Mentha-1,8-dien-3-yl-6-pentyl-beta-resorcylic acid|CHEMBL498672|CANNABIDIOLCARBOXYLIC ACID|DTXSID80154318|Cannabidiolic acid (CBDA)|2,4-dihydroxy-3-[(1r,6r)-3-methyl-6-(prop-1-en-2-yl)cyclohex-2-en-1-yl]-6-pentylbenzoic acid|CANNABIDIOLIC ACID (NFLIS-DRUG)|CANNABIDIOLIC ACID [NFLIS-DRUG]|BENZOIC ACID, 2,4-DIHYDROXY-3-((1R,6R)-3-METHYL-6-(1-METHYLETHENYL)-2-CYCLOHEXEN-1-YL)-6-PENTYL-|Benzoic acid, 2,4-dihydroxy-3-[(1R,6R)-3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl]-6-pentyl-|2,4-dihydroxy-3-((1R,6R)-3-methyl-6-(prop-1-en-2-yl)cyclohex-2-en-1-yl)-6-pentylbenzoic acid|SCHEMBL141666|DTXCID8076809|GTPL10600|BDBM50318485|LMPK13120003|Q27106043|Cannabidiolic acid (CBDA) 100 microg/mL in Acetonitrile|Cannabidiolic acid (CBDA) 1000 microg/mL in Acetonitrile|Cannabidiolic acid (CBDA) 250 microg/mL in Acetonitrile|2,4-dihydroxy-3-((1R,6R)-3-methyl-6-(prop-1-en-2-yl)cyclohex-2-enyl)-6-pentylbenzoic acid|Benzoic acid, 2,4-dihydroxy-3-[3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl]-6-pentyl-, (1R-trans)- |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.450 |
| Log Po/w (XLOGP3) : 6.600 |
| Log Po/w (WLOGP) : 5.540 |
| Log Po/w (MLOGP) : 3.790 |
| Log Po/w (SILICOS-IT) : 4.900 |
| Consensus Log Po/w : 4.860 |