TPCN05224
Name | 3-O-{??-L-rhamnopyranosyl-(1??2)-??-D-glucopyranosyl-(1??4)-??-L-arabinopyranosyl}cyclamiretin A;Saponin (12) |
Molecular Formula | C47H76O17 |
Molecular Weight | 913.11 |
CAS Registry Number | 162229-91-6 |
SMILES | CC1OC(OC2C(OC3COC(OC4CCC5(C)C(CCC6(C)C5CCC57OCC8(CCC(C)(C=O)CC85)C(O)CC67C)C4(C)C)C(O)C3O)OC(CO)C(O)C2O)C(O)C(O)C1O |
Classify | Triterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Myrsinaceae | Ardisia mamillata | Roots | 0.000400% | Chem Pharm Bull (Tokyo) . 2000 Oct;48(10):1413-7 | 10.1248/cpb.48.1413 |
Primulaceae | Ardisia japonica | Whole plants | 0.000033% | J Nat Prod 70, 179-187 (2007). | 10.1021/np0604681 |
Properties
HBA | 17 | HBD | 9 |
HeavyAtoms | 64 | AlogP | 0.67 |
TPSA | 263.75 | RotatableBonds | 8 |
FractionCSP3 | 0.98 | Rings | 9 |
AromaticRings | 0 | AliphaticRings | 9 |