Glycoside

GD119460
Name:
6-{[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy}-14-(furan-3-yl)-7,12-dihydroxy-4-[(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy]-3,5,7,9,11,13-hexamethyl-1-oxacyclotetradecane-2,10-dioneFormula:
C39H65O13NSmiles:
COC1(C)CC(OC2C(C)C(=O)OC(c3ccoc3)C(C)C(O)C(C)C(=O)C(C)CC(C)(O)C(OC3OC(C)CC(N(C)C)C3O)C2C)OC(C)C1OAglycone:
CC1CC(N(C)C)C(O)C(OC2C(C)C(O)C(C)C(=O)OC(c3ccoc3)C(C)C(O)C(C)C(=O)C(C)CC2(C)O)O1Sugarmoiety:
COC1(C)CC(O)OC(C)C1OOther Identifiers
Properties
HBA: | 14 | RingCount: | 4 |
HBD: | 4 | FractionCSP3: | 0.85 |
AlogP: | 3.23 | Num_rotatable_bonds: | 7 |
MolWt: | 755.94 | Num_heavy_atoms: | 53 |
TPSA: | 186.82 | NumAromaticRings: | 1 |
Unique Aglycone
AD47865
Formula: C31H51O10N
Smiles:
CC1CC(N(C)C)C(O)C(OC2C(C)C(O)C(C)C(=O)OC(c3ccoc3)C(C)C(O)C(C)C(=O)C(C)CC2(C)O)O1HBA: | 11 | RingCount: | 3 |
HBD: | 4 | FractionCSP3: | 0.81 |
AlogP: | 2.3 | Num_rotatable_bonds: | 4 |
MolWt: | 597.75 | Num_heavy_atoms: | 42 |
TPSA: | 159.13 | NumAromaticRings: | 1 |