Glycoside
GD016796
Name:
METHOXYHYGROMYCIN AFormula:
C23H31O12NSmiles:
CO[C@H]1[C@H](O)[C@@H](O)[C@@H](NC(=O)C(C)=Cc2ccc(O[C@@H]3O[C@H](C(C)=O)[C@H](O)[C@H]3O)c(O)c2)[C@@H](O)[C@H]1OAglycone:
COC1C(O)C(O)C(NC(=O)C(C)=Cc2ccc(O)c(O)c2)C(O)C1OSugarmoiety:
CC(=O)C1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 8 | FractionCSP3: | 0.57 |
| AlogP: | -2.83 | Num_rotatable_bonds: | 7 |
| MolWt: | 513.5 | Num_heavy_atoms: | 36 |
| TPSA: | 215.47 | NumAromaticRings: | 1 |
Unique Aglycone
AD12049
Formula: C17H23O8N
Smiles:
COC1C(O)C(O)C(NC(=O)C(C)=Cc2ccc(O)c(O)c2)C(O)C1O| HBA: | 9 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.47 |
| AlogP: | -1.54 | Num_rotatable_bonds: | 4 |
| MolWt: | 369.37 | Num_heavy_atoms: | 26 |
| TPSA: | 159.71 | NumAromaticRings: | 1 |
