Glycoside
GD101881
Name:
NoneFormula:
C21H34O8N2SSmiles:
C[C@@H]1O[C@@H](OCCNC(=O)C[C@H](Cc2cccs2)NC(=O)OC(C)(C)C)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
CC(C)(C)OC(=O)NC(CC(=O)NCCO)Cc1cccs1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.71 |
| AlogP: | 0.53 | Num_rotatable_bonds: | 9 |
| MolWt: | 474.58 | Num_heavy_atoms: | 32 |
| TPSA: | 146.58 | NumAromaticRings: | 1 |
Unique Aglycone
AD43135
Formula: C15H24O4N2S
Smiles:
CC(C)(C)OC(=O)NC(CC(=O)NCCO)Cc1cccs1| HBA: | 6 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.6 |
| AlogP: | 1.68 | Num_rotatable_bonds: | 7 |
| MolWt: | 328.43 | Num_heavy_atoms: | 22 |
| TPSA: | 87.66 | NumAromaticRings: | 1 |
