Glycoside
GD129760
Name:
N-DemethylstreptomycinFormula:
C20H37O12N7Smiles:
CC1OC(OC2C(O)C(O)C(NC(=N)N)C(O)C2NC(=N)N)C(OC2OC(CO)C(O)C(O)C2N)C1(O)C=OAglycone:
N=C(N)NC1C(O)C(O)C(O)C(NC(=N)N)C1OSugarmoiety:
CC1OC(O)C(OC2OC(CO)C(O)C(O)C2N)C1(O)C=OOther Identifiers
Properties
| HBA: | 19 | RingCount: | 3 |
| HBD: | 17 | FractionCSP3: | 0.85 |
| AlogP: | -8.0 | Num_rotatable_bonds: | 8 |
| MolWt: | 567.55 | Num_heavy_atoms: | 39 |
| TPSA: | 345.42 | NumAromaticRings: | 0 |
Unique Aglycone
AD07399
Formula: C8H18O4N6
Smiles:
N=C(N)NC1C(O)C(O)C(O)C(NC(=N)N)C1O| HBA: | 10 | RingCount: | 1 |
| HBD: | 12 | FractionCSP3: | 0.75 |
| AlogP: | -4.85 | Num_rotatable_bonds: | 2 |
| MolWt: | 262.27 | Num_heavy_atoms: | 18 |
| TPSA: | 204.72 | NumAromaticRings: | 0 |
