Glycoside
GD151502
Name:
N-[2-(9-{[4-(dimethylamino)-3,5-dihydroxy-6-methyloxan-2-yl]oxy}-3-ethyl-7-hydroxy-2,8,12,16-tetramethyl-5,13-dioxo-4,17-dioxabicyclo[14.1.0]heptadec-14-en-10-yl)ethylidene]ethanehydrazonic acidFormula:
C33H55O10N3Smiles:
CCC1OC(=O)CC(O)C(C)C(OC2OC(C)C(O)C(N(C)C)C2O)C(CC=NN=C(C)O)CC(C)C(=O)C=CC2(C)OC2C1CAglycone:
CCC1OC(=O)CC(O)C(C)C(O)C(CC=NN=C(C)O)CC(C)C(=O)C=CC2(C)OC2C1CSugarmoiety:
CC1OC(O)C(O)C(N(C)C)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.82 |
| AlogP: | 2.4 | Num_rotatable_bonds: | 7 |
| MolWt: | 653.81 | Num_heavy_atoms: | 46 |
| TPSA: | 183.24 | NumAromaticRings: | 0 |
Unique Aglycone
AD60414
Formula: C25H40O7N2
Smiles:
CCC1OC(=O)CC(O)C(C)C(O)C(CC=NN=C(C)O)CC(C)C(=O)C=CC2(C)OC2C1C| HBA: | 9 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.76 |
| AlogP: | 2.98 | Num_rotatable_bonds: | 4 |
| MolWt: | 480.6 | Num_heavy_atoms: | 34 |
| TPSA: | 141.31 | NumAromaticRings: | 0 |
