Glycoside
GD138029
Name:
Cytosaminomycin AFormula:
C22H34O8N4SSmiles:
CSC=CC(=O)N=c1ccn(C2CC(O)C(OC3OC(C)C(N(C)C)C(O)C3O)C(C)O2)c(O)n1Aglycone:
CSC=CC(=O)N=c1ccn(C2CC(O)C(O)C(C)O2)c(O)n1Sugarmoiety:
CC1OC(O)C(O)C(O)C1N(C)COther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.68 |
| AlogP: | -0.66 | Num_rotatable_bonds: | 6 |
| MolWt: | 514.6 | Num_heavy_atoms: | 35 |
| TPSA: | 159.1 | NumAromaticRings: | 1 |
Unique Aglycone
AD55737
Formula: C14H19O5N3S
Smiles:
CSC=CC(=O)N=c1ccn(C2CC(O)C(O)C(C)O2)c(O)n1| HBA: | 8 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.5 |
| AlogP: | -0.08 | Num_rotatable_bonds: | 3 |
| MolWt: | 341.39 | Num_heavy_atoms: | 23 |
| TPSA: | 117.17 | NumAromaticRings: | 1 |
