Glycoside
GD127145
Name:
2-({4a,5-dihydroxy-7-methyl-1H,4aH,5H,6H,7H,7aH-cyclopenta[c]pyran-7-yl}oxy)-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C15H24O9Smiles:
CC1(OC2OC(CO)C(O)C(O)C2O)CC(O)C2(O)C=COCC12Aglycone:
CC1(O)CC(O)C2(O)C=COCC12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.87 |
| AlogP: | -2.78 | Num_rotatable_bonds: | 3 |
| MolWt: | 348.35 | Num_heavy_atoms: | 24 |
| TPSA: | 149.07 | NumAromaticRings: | 0 |
Unique Aglycone
AD51475
Formula: C9H14O4
Smiles:
CC1(O)CC(O)C2(O)C=COCC12| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.78 |
| AlogP: | -0.61 | Num_rotatable_bonds: | 0 |
| MolWt: | 186.21 | Num_heavy_atoms: | 13 |
| TPSA: | 69.92 | NumAromaticRings: | 0 |
