Glycoside

GD141247
Name:
6-{[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy}-14-ethyl-4-[(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy]-3,5,7,9,11,13-hexamethyl-1-oxacyclotetradecane-2,7,10,12,13-pentolFormula:
C37H71O13NSmiles:
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(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)C(O)C(C)C(O)C1(C)OSugarmoiety:
COC1(C)CC(O)OC(C)C1OOther Identifiers
Properties
HBA: | 14 | RingCount: | 3 |
HBD: | 7 | FractionCSP3: | 1.0 |
AlogP: | 1.37 | Num_rotatable_bonds: | 7 |
MolWt: | 737.97 | Num_heavy_atoms: | 51 |
TPSA: | 200.23 | NumAromaticRings: | 0 |
Unique Aglycone
AD56918
Formula: C29H57O10N
Smiles:
CCC1OC(O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)C(O)C(C)C(O)C1(C)OHBA: | 11 | RingCount: | 2 |
HBD: | 7 | FractionCSP3: | 1.0 |
AlogP: | 0.44 | Num_rotatable_bonds: | 4 |
MolWt: | 579.77 | Num_heavy_atoms: | 40 |
TPSA: | 172.54 | NumAromaticRings: | 0 |