Glycoside
GD129033
Name:
3-{[3,4-dihydroxy-6-(hydroxymethyl)-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-4,5-dihydroxy-6-[(4,5,6-trihydroxy-2-methyloxan-3-yl)oxy]oxane-2-carboxylic acidFormula:
C24H40O21Smiles:
CC1OC(O)C(O)C(O)C1OC1OC(C(=O)O)C(OC2OC(CO)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)C(O)C1OAglycone:
[empty]Sugarmoiety:
CC1OC(O)C(O)C(O)C1OC1OC(C(=O)O)C(OC2OC(CO)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 21 | RingCount: | 4 |
| HBD: | 13 | FractionCSP3: | 0.96 |
| AlogP: | -8.63 | Num_rotatable_bonds: | 9 |
| MolWt: | 664.56 | Num_heavy_atoms: | 45 |
| TPSA: | 344.67 | NumAromaticRings: | 0 |
Unique Aglycone
Sugarmoiety
SD07036
CC1OC(O)C(O)C(O)C1OC1OC(C(=O)O)C(OC2OC(CO)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)C(O)C1O