Glycoside
GD152957
Name:
5-IminoaranciamycinFormula:
C27H29O11NSmiles:
COC1C(OC2c3c(cc4c(c3O)C(N)=C3C(=O)C=CC=C3C4=O)C(=O)C(C)(O)C2OC)OC(C)C(O)C1OAglycone:
COC1C(O)c2c(cc3c(c2O)C(N)=C2C(=O)C=CC=C2C3=O)C(=O)C1(C)OSugarmoiety:
COC1C(O)OC(C)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.44 |
| AlogP: | -0.17 | Num_rotatable_bonds: | 4 |
| MolWt: | 543.53 | Num_heavy_atoms: | 39 |
| TPSA: | 195.07 | NumAromaticRings: | 1 |
Unique Aglycone
AD60857
Formula: C20H17O7N
Smiles:
COC1C(O)c2c(cc3c(c2O)C(N)=C2C(=O)C=CC=C2C3=O)C(=O)C1(C)O| HBA: | 8 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.25 |
| AlogP: | 0.32 | Num_rotatable_bonds: | 1 |
| MolWt: | 383.36 | Num_heavy_atoms: | 28 |
| TPSA: | 147.15 | NumAromaticRings: | 1 |
