Glycoside
GD145358
Name:
10-{[10-({4,5-dihydroxy-6-methyl-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)decanoyl]oxy}decanoic acidFormula:
C32H58O13Smiles:
CC1OC(OC2C(OCCCCCCCCCC(=O)OCCCCCCCCCC(=O)O)OC(C)C(O)C2O)C(O)C(O)C1OAglycone:
O=C(O)CCCCCCCCCOC(=O)CCCCCCCCCOSugarmoiety:
CC1OC(OC2C(O)OC(C)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.94 |
| AlogP: | 2.55 | Num_rotatable_bonds: | 23 |
| MolWt: | 650.8 | Num_heavy_atoms: | 45 |
| TPSA: | 201.67 | NumAromaticRings: | 0 |
Unique Aglycone
AD58357
Formula: C20H38O5
Smiles:
O=C(O)CCCCCCCCCOC(=O)CCCCCCCCCO| HBA: | 5 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.9 |
| AlogP: | 4.85 | Num_rotatable_bonds: | 19 |
| MolWt: | 358.52 | Num_heavy_atoms: | 25 |
| TPSA: | 83.83 | NumAromaticRings: | 0 |
