TPCN05383

Name Catunaroside C
Molecular Formula C54H88O23
Molecular Weight 1105.28
CAS Registry Number 1244548-40-0
SMILES CC1OC(OC2C(OC3CCC4(C)C(CCC5(C)C4CC=C4C6C(O)C(C)(C)CCC6(C(=O)OC6OC(CO)C(O)C(O)C6O)CCC45C)C3(C)C)OC(CO)C(O)C2OC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Rubiaceae Catunaregam spinosa Barks 0.001956% Carbohydr Res. 2011. 346, 2200-2205. 10.1016/j.carres.2011.07.022.
Properties
HBA 23 HBD 14
HeavyAtoms 77 AlogP -2.04
TPSA 374.13 RotatableBonds 11
FractionCSP3 0.94 Rings 9
AromaticRings 0 AliphaticRings 9