TPCN06098

Name Anchusoside-11
Molecular Formula C47H76O19
Molecular Weight 945.11
CAS Registry Number 118201-56-2
SMILES CC1(C)CC2C3=CCC4C5(C)CCC(OC6OCC(O)C(O)C6O)C(C)(CO)C5CCC4(C)C3(C)CCC2(C(=O)O)CC1OC1OC(CO)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Boraginaceae Anchusa undulata Aerial parts 0.000920% Nat Prod Res . 2009;23(3):284-92 10.1080/14786410802006140
Properties
HBA 19 HBD 12
HeavyAtoms 66 AlogP -0.71
TPSA 315.21 RotatableBonds 10
FractionCSP3 0.94 Rings 8
AromaticRings 0 AliphaticRings 8