TPCN05981

Name Transsylvanoside H
Molecular Formula C46H74O16
Molecular Weight 883.08
CAS Registry Number 174423-50-8
SMILES CC1OC(OC2C(OC3CCC4(C)C(CCC5(C)C4CC=C4C6CC(C)(C)CCC6(C(=O)O)CCC45C)C3(C)CO)OCC(O)C2O)C(O)C(OC2OCC(O)C(O)C2O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Caprifoliaceae Cephalaria transsylvanica Flowers 0.004333% J Nat Prod . 1996 Apr;59(4):415-8 10.1021/np960193x
Properties
HBA 16 HBD 9
HeavyAtoms 62 AlogP 1.98
TPSA 254.52 RotatableBonds 8
FractionCSP3 0.93 Rings 8
AromaticRings 0 AliphaticRings 8