TPCN03428
Name | Spiro[furan-3(2H),6??-[6H]naphtho[1,8-bc]furan]-2??a(2??H)-carboxylic acid, 3??-(acetyloxy)-5-(3-furanyl)-3??,4,4??,5,5??,7??,8??,8??a-octahydro-7??-methyl-2-oxo-, methyl ester, (2??aS,3R,3??S,5S,7??R,8??aS)- |
Molecular Formula | C23H26O8 |
Molecular Weight | 430.45 |
CAS Registry Number | 2387823-66-5 |
SMILES | COC(=O)C12COC3CC(C)C4(CC(c5ccoc5)OC4=O)C(=C31)CCC2OC(C)=O |
Classify | Diterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Euphorbiaceae | Croton crassifolius | Roots | 0.000338% | Natural Product Research, 35(9), 1421-1427 | 10.1080/14786419.2019.1652290 |
Properties
HBA | 8 | HBD | 0 |
HeavyAtoms | 31 | AlogP | 2.87 |
TPSA | 101.27 | RotatableBonds | 3 |
FractionCSP3 | 0.61 | Rings | 5 |
AromaticRings | 1 | AliphaticRings | 4 |