Glycoside

GD016301
Name:
NoneFormula:
C37H62O20N8Smiles:
CC(=O)N[C@@H]1[C@H](O[C@@H]2[C@H](CO)O[C@H](O)[C@H](NC(C)=O)[C@H]2OC(C)C(=O)N[C@H](C)C(=O)N[C@H](CCC(=O)N[C@H](CCC[C@H](N)C(=O)O)C(=O)NC(=O)[C@H](C)N)C(=O)O)O[C@H](CO)[C@H](O)[C@H]1OAglycone:
CC(N)C(=O)NC(=O)C(CCCC(N)C(=O)O)NC(=O)CCC(NC(=O)C(C)NC(=O)C(C)O)C(=O)OSugarmoiety:
CC(=O)NC1C(O)OC(CO)C(OC2OC(CO)C(O)C(O)C2NC(C)=O)C1OOther Identifiers
Properties
HBA: | 28 | RingCount: | 2 |
HBD: | 17 | FractionCSP3: | 0.76 |
AlogP: | -7.79 | Num_rotatable_bonds: | 24 |
MolWt: | 938.94 | Num_heavy_atoms: | 65 |
TPSA: | 456.38 | NumAromaticRings: | 0 |
Unique Aglycone
AD11759
Formula: C21H36O10N6
Smiles:
CC(N)C(=O)NC(=O)C(CCCC(N)C(=O)O)NC(=O)CCC(NC(=O)C(C)NC(=O)C(C)O)C(=O)OHBA: | 16 | RingCount: | 0 |
HBD: | 11 | FractionCSP3: | 0.67 |
AlogP: | -3.72 | Num_rotatable_bonds: | 16 |
MolWt: | 532.55 | Num_heavy_atoms: | 37 |
TPSA: | 280.34 | NumAromaticRings: | 0 |