TPCN04973

Name Brachyosides C
Molecular Formula C47H80O19
Molecular Weight 949.14
CAS Registry Number 215776-56-0
SMILES CC(CCC(OC1OC(CO)C(O)C(O)C1O)C(C)(C)O)C1C(O)CC2(C)C3CC(OC4OC(CO)C(O)C(O)C4O)C4C(C)(C)C(OC5OCC(O)C(O)C5O)CCC45CC35CCC12C
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Fabaceae Astragalus brachypterus Roots 0.003000% J Nat Prod 61, 1469-1472 (1998) 10.1021/np9801763
Properties
HBA 19 HBD 13
HeavyAtoms 66 AlogP -1.61
TPSA 318.37 RotatableBonds 13
FractionCSP3 1.00 Rings 8
AromaticRings 0 AliphaticRings 8