Glycoside
GD143863
Name:
3-({3-[(6-carboxy-3,4,5-trihydroxyoxan-2-yl)oxy]-4,5-dihydroxy-6-methyloxan-2-yl}oxy)-4,5-dihydroxy-6-[(2,4,5-trihydroxy-6-methyloxan-3-yl)oxy]oxane-2-carboxylic acidFormula:
C24H38O21Smiles:
CC1OC(O)C(OC2OC(C(=O)O)C(OC3OC(C)C(O)C(O)C3OC3OC(C(=O)O)C(O)C(O)C3O)C(O)C2O)C(O)C1OAglycone:
[empty]Sugarmoiety:
CC1OC(O)C(OC2OC(C(=O)O)C(OC3OC(C)C(O)C(O)C3OC3OC(C(=O)O)C(O)C(O)C3O)C(O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 21 | RingCount: | 4 |
| HBD: | 12 | FractionCSP3: | 0.92 |
| AlogP: | -7.51 | Num_rotatable_bonds: | 8 |
| MolWt: | 662.55 | Num_heavy_atoms: | 45 |
| TPSA: | 341.51 | NumAromaticRings: | 0 |
Unique Aglycone
Sugarmoiety
SD09018
CC1OC(O)C(OC2OC(C(=O)O)C(OC3OC(C)C(O)C(O)C3OC3OC(C(=O)O)C(O)C(O)C3O)C(O)C2O)C(O)C1O