Glycoside
GD116979
Name:
12-{[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy}-6-ethyl-4,5-dihydroxy-10-[(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy]-3,5,9,11,13,15-hexamethyl-7,16-dioxa-2-azabicyclo[11.2.1]hexadec-1-en-8-oneFormula:
C37H66O12N2Smiles:
CCC1OC(=O)C(C)C(OC2CC(C)(OC)C(O)C(C)O2)C(C)C(OC2OC(C)CC(N(C)C)C2O)C2(C)CC(C)C(=NC(C)C(O)C1(C)O)O2Aglycone:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C2(C)CC(C)C(=NC(C)C(O)C1(C)O)O2Sugarmoiety:
COC1(C)CC(O)OC(C)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.95 |
| AlogP: | 2.41 | Num_rotatable_bonds: | 7 |
| MolWt: | 730.94 | Num_heavy_atoms: | 51 |
| TPSA: | 178.2 | NumAromaticRings: | 0 |
Unique Aglycone
AD46564
Formula: C29H52O9N2
Smiles:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C2(C)CC(C)C(=NC(C)C(O)C1(C)O)O2| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.93 |
| AlogP: | 1.48 | Num_rotatable_bonds: | 4 |
| MolWt: | 572.74 | Num_heavy_atoms: | 40 |
| TPSA: | 150.51 | NumAromaticRings: | 0 |
