TPCN03018
Name | 3b-hydroxy12-O-b-D-glucopyranosyl-8,11,13-abietatrien-7-one;3b-hydroxy-12-O-b-D-glucopyranosyl-8,11,13-abietatrien-7-one |
Molecular Formula | C26H38O8 |
Molecular Weight | 478.58 |
CAS Registry Number | 1555975-07-9 |
SMILES | CC(C)c1cc2c(cc1OC1OC(CO)C(O)C(O)C1O)C1(C)CCC(O)C(C)(C)C1CC2=O |
Classify | Diterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Lamiaceae | Clinopodium chinense | Aerial parts | 0.000100% | Nat Prod Res 28, 467-472 (2014). | 10.1080/14786419.2013.879132 |
Lamiaceae | Clinopodium chinense | Aerial parts | 0.000052% | Nat Prod Res, 1-9 (2019). | 10.1080/14786419.2019.1611811 |
Properties
HBA | 8 | HBD | 5 |
HeavyAtoms | 34 | AlogP | 1.63 |
TPSA | 136.68 | RotatableBonds | 4 |
FractionCSP3 | 0.73 | Rings | 4 |
AromaticRings | 1 | AliphaticRings | 3 |