Glycoside
GD132839
Name:
9-[(4,5-dihydroxy-4,6-dimethyloxan-2-yl)oxy]-3,4-dihydroxy-11-({3-hydroxy-6-methyl-4-[methyl(propan-2-yl)amino]oxan-2-yl}oxy)-5-(1-hydroxyethyl)-2,4,8,10,12,14-hexamethyl-6,15-dioxabicyclo[10.2.1]pentadec-1(14)-en-7-oneFormula:
C38H67O13NSmiles:
CC1=C2OC(C)(C1)C(OC1OC(C)CC(N(C)C(C)C)C1O)C(C)C(OC1CC(C)(O)C(O)C(C)O1)C(C)C(=O)OC(C(C)O)C(C)(O)C(O)C2CAglycone:
CC1=C2OC(C)(C1)C(OC1OC(C)CC(N(C)C(C)C)C1O)C(C)C(O)C(C)C(=O)OC(C(C)O)C(C)(O)C(O)C2CSugarmoiety:
CC1OC(O)CC(C)(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.92 |
| AlogP: | 1.99 | Num_rotatable_bonds: | 7 |
| MolWt: | 745.95 | Num_heavy_atoms: | 52 |
| TPSA: | 197.07 | NumAromaticRings: | 0 |
Unique Aglycone
AD53750
Formula: C31H55O10N
Smiles:
CC1=C2OC(C)(C1)C(OC1OC(C)CC(N(C)C(C)C)C1O)C(C)C(O)C(C)C(=O)OC(C(C)O)C(C)(O)C(O)C2C| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.9 |
| AlogP: | 1.72 | Num_rotatable_bonds: | 5 |
| MolWt: | 601.78 | Num_heavy_atoms: | 42 |
| TPSA: | 158.38 | NumAromaticRings: | 0 |
