TPCN03429
Name | Spiro[furan-3(2H),1??(2??H)-naphthalene]-5??-carboxylic acid, 6??-(acetyloxy)-5??-[(acetyloxy)methyl]-5-(3-furanyl)-3??,4,4??,5,5??,6??,7??,8??-octahydro-4??-hydroxy-2??-methyl-2-oxo-, methyl ester, (1??R,2??R,4??S,5S,5??S,6??S)- |
Molecular Formula | C25H30O10 |
Molecular Weight | 490.51 |
CAS Registry Number | 2387823-67-6 |
SMILES | COC(=O)C1(COC(C)=O)C2=C(CCC1OC(C)=O)C1(CC(c3ccoc3)OC1=O)C(C)CC2O |
Classify | Diterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Euphorbiaceae | Croton crassifolius | Roots | 0.000213% | None | 10.1080/14786419.2019.1652290 |
Properties
HBA | 10 | HBD | 1 |
HeavyAtoms | 35 | AlogP | 2.40 |
TPSA | 138.57 | RotatableBonds | 5 |
FractionCSP3 | 0.60 | Rings | 4 |
AromaticRings | 1 | AliphaticRings | 3 |