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