Glycoside
GD154819
Name:
20-[(4-amino-3,5-dihydroxy-6-methyloxan-2-yl)oxy]-4,6,8,11,12,16,18,36-octahydroxy-35,37,38-trimethyl-2,14-dioxo-1-oxacyclooctatriacontane-17-carboxylic acidFormula:
C47H87O17NSmiles:
CC1CCCCCCCCCCCCCCC(OC2OC(C)C(O)C(N)C2O)CC(O)C(C(=O)O)C(O)CC(=O)CC(O)C(O)CCC(O)CC(O)CC(O)CC(=O)OC(C)C(C)C1OAglycone:
CC1CCCCCCCCCCCCCCC(O)CC(O)C(C(=O)O)C(O)CC(=O)CC(O)C(O)CCC(O)CC(O)CC(O)CC(=O)OC(C)C(C)C1OSugarmoiety:
CC1OC(O)C(O)C(N)C1OOther Identifiers
Properties
| HBA: | 18 | RingCount: | 2 |
| HBD: | 13 | FractionCSP3: | 0.94 |
| AlogP: | 2.12 | Num_rotatable_bonds: | 3 |
| MolWt: | 938.2 | Num_heavy_atoms: | 65 |
| TPSA: | 327.45 | NumAromaticRings: | 0 |
Unique Aglycone
AD61461
Formula: C41H76O14
Smiles:
CC1CCCCCCCCCCCCCCC(O)CC(O)C(C(=O)O)C(O)CC(=O)CC(O)C(O)CCC(O)CC(O)CC(O)CC(=O)OC(C)C(C)C1O| HBA: | 14 | RingCount: | 1 |
| HBD: | 10 | FractionCSP3: | 0.93 |
| AlogP: | 3.3 | Num_rotatable_bonds: | 1 |
| MolWt: | 793.05 | Num_heavy_atoms: | 55 |
| TPSA: | 262.74 | NumAromaticRings: | 0 |
