TPCN04881

Name Durantanin V
Molecular Formula C59H96O26
Molecular Weight 1221.39
CAS Registry Number 1193750-94-5
SMILES CC1OC(OC2COC(OC3CCC4(C)C(CCC5(C)C4CC=C4C6CC(C)(C)CCC6(C(=O)OC6OC(COC7OC(CO)C(OC8OC(C)C(O)C(O)C8O)C(O)C7O)C(O)C(O)C6O)CCC45C)C3(C)CO)C(O)C2O)C(O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Verbenaceae Duranta repens Leaves 0.013333% Molecules 14, 1952-1965 (2009). 10.3390/molecules14051952
Properties
HBA 26 HBD 15
HeavyAtoms 85 AlogP -2.54
TPSA 412.82 RotatableBonds 13
FractionCSP3 0.95 Rings 10
AromaticRings 0 AliphaticRings 10