TPCN05942
Name | 3-O-[??-L-arabinopyranosyl (1-2)]??-L-arabinopyranosyl (1-6)] 2-acetamido-2-deoxy-??-D-glucopyranosyl echinocystic acid |
Molecular Formula | C48H77NO17 |
Molecular Weight | 940.13 |
CAS Registry Number | 121817-27-4 |
SMILES | CC(=O)NC1C(OC2CCC3(C)C(CCC4(C)C3CC=C3C5CC(C)(C)CCC5(C(=O)O)C(O)CC34C)C2(C)C)OC(COC2OCC(O)C(O)C2OC2OCC(O)C(O)C2O)C(O)C1O |
Classify | Triterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Fabaceae | Zygia racemosa | Barks | 0.010000% | Pharm Res . 1997 Mar;14(3):358-61 | 10.1023/a:1012010407824 |
Properties
HBA | 18 | HBD | 10 |
HeavyAtoms | 66 | AlogP | 1.10 |
TPSA | 283.62 | RotatableBonds | 9 |
FractionCSP3 | 0.92 | Rings | 8 |
AromaticRings | 0 | AliphaticRings | 8 |