Glycoside
GD136566
Name:
Methylpendolmycin-14-O-Alpha-GlucosideFormula:
C29H43O7N3Smiles:
C=CC(C)(C)c1ccc2c3c(c[nH]c13)CC(COC1OC(CO)C(O)C(O)C1O)N=C(O)C(C(C)CC)N2CAglycone:
C=CC(C)(C)c1ccc2c3c(c[nH]c13)CC(CO)N=C(O)C(C(C)CC)N2CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.62 |
| AlogP: | 2.18 | Num_rotatable_bonds: | 8 |
| MolWt: | 545.68 | Num_heavy_atoms: | 39 |
| TPSA: | 151.0 | NumAromaticRings: | 2 |
Unique Aglycone
AD55207
Formula: C23H33O2N3
Smiles:
C=CC(C)(C)c1ccc2c3c(c[nH]c13)CC(CO)N=C(O)C(C(C)CC)N2C| HBA: | 5 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.52 |
| AlogP: | 4.36 | Num_rotatable_bonds: | 5 |
| MolWt: | 383.54 | Num_heavy_atoms: | 28 |
| TPSA: | 71.85 | NumAromaticRings: | 2 |
