Glycoside

GD144177
Name:
6-{[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy}-14-ethyl-7,12,13-trihydroxy-4-[(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy]-10-imino-3,5,7,9,11,13-hexamethyl-1-oxacyclotetradecan-2-oneFormula:
C37H68O12N2Smiles:
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)C(=N)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)C(=N)C(C)C(O)C1(C)OSugarmoiety:
COC1(C)CC(O)OC(C)C1OOther Identifiers
Properties
HBA: | 14 | RingCount: | 3 |
HBD: | 6 | FractionCSP3: | 0.95 |
AlogP: | 2.24 | Num_rotatable_bonds: | 7 |
MolWt: | 732.95 | Num_heavy_atoms: | 51 |
TPSA: | 200.69 | NumAromaticRings: | 0 |
Unique Aglycone
AD57956
Formula: C29H54O9N2
Smiles:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)C(=N)C(C)C(O)C1(C)OHBA: | 11 | RingCount: | 2 |
HBD: | 6 | FractionCSP3: | 0.93 |
AlogP: | 1.31 | Num_rotatable_bonds: | 4 |
MolWt: | 574.76 | Num_heavy_atoms: | 40 |
TPSA: | 173.0 | NumAromaticRings: | 0 |