TPCN05824

Name 7,8-dihydroisoxuxuarine Fa
Molecular Formula C58H76O8
Molecular Weight 901.24
CAS Registry Number 758708-87-1
SMILES COC(=O)C1(C)CCC2(C)CCC3(C)C4=CC(=O)c5c(cc6c(c5C)OC5(O)C(=O)C=C7C(=CCC8C7(C)CCC7(C)C9CC(C)C(=O)CC9(C)CCC87C)C5(C)O6)C4(C)CCC3(C)C2C1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Celastraceae Maytenus chuchuhuasca Barks 0.000166% Chem Pharm Bull (Tokyo). 2004 Jun;52(6):739-46. 10.1248/cpb.52.739.
Properties
HBA 8 HBD 1
HeavyAtoms 66 AlogP 11.86
TPSA 116.20 RotatableBonds 1
FractionCSP3 0.72 Rings 11
AromaticRings 1 AliphaticRings 10