Glycoside
GD137200
Name:
6-{[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy}-14-ethyl-7,9,12,13-tetrahydroxy-4-[(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy]-3,5,7,9,11,13-hexamethyl-1-oxacyclotetradecane-2,10-dioneFormula:
C37H67O14NSmiles:
CCC1OC(=O)C(C)C(OC2CC(C)(OC)C(O)C(C)O2)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)(O)C(=O)C(C)C(O)C1(C)OAglycone:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)(O)C(=O)C(C)C(O)C1(C)OSugarmoiety:
COC1(C)CC(O)OC(C)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.95 |
| AlogP: | 0.9 | Num_rotatable_bonds: | 7 |
| MolWt: | 749.94 | Num_heavy_atoms: | 52 |
| TPSA: | 214.14 | NumAromaticRings: | 0 |
Unique Aglycone
AD55440
Formula: C29H53O11N
Smiles:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)(O)C(=O)C(C)C(O)C1(C)O| HBA: | 12 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.93 |
| AlogP: | -0.02 | Num_rotatable_bonds: | 4 |
| MolWt: | 591.74 | Num_heavy_atoms: | 41 |
| TPSA: | 186.45 | NumAromaticRings: | 0 |
