Glycoside
GD115487
Name:
2-{[4,5-dihydroxy-6-(hydroxymethyl)-2-[(3,7,11-trimethyldodeca-1,6,10-trien-3-yl)oxy]oxan-3-yl]oxy}-6-methyloxane-3,4,5-triolFormula:
C27H46O10Smiles:
C=CC(C)(CCC=C(C)CCC=C(C)C)OC1OC(CO)C(O)C(O)C1OC1OC(C)C(O)C(O)C1OAglycone:
C=CC(C)(O)CCC=C(C)CCC=C(C)CSugarmoiety:
CC1OC(OC2C(O)OC(CO)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.78 |
| AlogP: | 1.07 | Num_rotatable_bonds: | 12 |
| MolWt: | 530.66 | Num_heavy_atoms: | 37 |
| TPSA: | 158.3 | NumAromaticRings: | 0 |
Unique Aglycone
AD45694
Formula: C15H26O
Smiles:
C=CC(C)(O)CCC=C(C)CCC=C(C)C| HBA: | 1 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.6 |
| AlogP: | 4.4 | Num_rotatable_bonds: | 7 |
| MolWt: | 222.37 | Num_heavy_atoms: | 16 |
| TPSA: | 20.23 | NumAromaticRings: | 0 |
