Glycoside

GD012268
Name:
NoneFormula:
C36H58O20N8Smiles:
CC(=O)N[C@H]1[C@H]2OC[C@H](O2)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2NC(C)=O)[C@H]1O[C@H](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)N[C@H](N)C(=O)O)C(=O)OAglycone:
CC(=O)NC1C2OCC(O2)C(O)C1OC(C)C(=O)NC(C)C(=O)NC(CCC(=O)NC(CCCC(N)C(=O)O)C(=O)NC(N)C(=O)O)C(=O)OSugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
HBA: | 28 | RingCount: | 3 |
HBD: | 16 | FractionCSP3: | 0.75 |
AlogP: | -7.24 | Num_rotatable_bonds: | 24 |
MolWt: | 922.9 | Num_heavy_atoms: | 64 |
TPSA: | 445.38 | NumAromaticRings: | 0 |
Unique Aglycone
AD09265
Formula: C28H45O15N7
Smiles:
CC(=O)NC1C2OCC(O2)C(O)C1OC(C)C(=O)NC(C)C(=O)NC(CCC(=O)NC(CCCC(N)C(=O)O)C(=O)NC(N)C(=O)O)C(=O)OHBA: | 22 | RingCount: | 2 |
HBD: | 13 | FractionCSP3: | 0.71 |
AlogP: | -5.21 | Num_rotatable_bonds: | 20 |
MolWt: | 719.7 | Num_heavy_atoms: | 50 |
TPSA: | 357.36 | NumAromaticRings: | 0 |