Glycoside
GD024602
Name:
SUMATRANOSIDEFormula:
C48H93O10NSmiles:
CCCCCCCCC=CCCCC[C@H](O)[C@H](O)C(CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)NC(=O)[C@H](O)CCCCCCCCCCCCCCCCCCCCCCAglycone:
CCCCCCCCC=CCCCCC(O)C(O)C(CO)NC(=O)C(O)CCCCCCCCCCCCCCCCCCCCCCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 1 |
| HBD: | 8 | FractionCSP3: | 0.94 |
| AlogP: | 8.45 | Num_rotatable_bonds: | 41 |
| MolWt: | 844.27 | Num_heavy_atoms: | 59 |
| TPSA: | 189.17 | NumAromaticRings: | 0 |
Unique Aglycone
AD16397
Formula: C42H83O5N
Smiles:
CCCCCCCCC=CCCCCC(O)C(O)C(CO)NC(=O)C(O)CCCCCCCCCCCCCCCCCCCCCC| HBA: | 6 | RingCount: | 0 |
| HBD: | 5 | FractionCSP3: | 0.93 |
| AlogP: | 10.63 | Num_rotatable_bonds: | 38 |
| MolWt: | 682.13 | Num_heavy_atoms: | 48 |
| TPSA: | 110.02 | NumAromaticRings: | 0 |
