TPCN04434

Name 3,7-dihydroxy-25- methoxycucurbita-5,23-dien-19-al
Molecular Formula C31H50O4
Molecular Weight 486.74
CAS Registry Number 132587-67-8
SMILES COC(C)(C)C=CCC(C)C1CCC2(C)C3C(O)C=C4C(CCC(O)C4(C)C)C3(C=O)CCC12C
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Cucurbitaceae Momordica charantia Stems 0.000650% Nat Prod Res 30(8): 973-978. 10.1080/14786419.2015.1089241
Properties
HBA 4 HBD 2
HeavyAtoms 35 AlogP 6.11
TPSA 66.76 RotatableBonds 6
FractionCSP3 0.84 Rings 4
AromaticRings 0 AliphaticRings 4