Glycoside
GD127029
Name:
2-({1,7-dihydroxy-3a,3b,6,9a-tetramethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-6-yl}methoxy)-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C28H48O8Smiles:
CC1(COC2OC(CO)C(O)C(O)C2O)C(O)CCC2(C)C1CCC1(C)C2CCC2C(O)CCC21CAglycone:
CC1(CO)C(O)CCC2(C)C1CCC1(C)C2CCC2C(O)CCC21CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 1.0 |
| AlogP: | 1.57 | Num_rotatable_bonds: | 4 |
| MolWt: | 512.68 | Num_heavy_atoms: | 36 |
| TPSA: | 139.84 | NumAromaticRings: | 0 |
Unique Aglycone
AD51422
Formula: C22H38O3
Smiles:
CC1(CO)C(O)CCC2(C)C1CCC1(C)C2CCC2C(O)CCC21C| HBA: | 3 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | 3.75 | Num_rotatable_bonds: | 1 |
| MolWt: | 350.54 | Num_heavy_atoms: | 25 |
| TPSA: | 60.69 | NumAromaticRings: | 0 |
