Glycoside
GD117691
Name:
Respinomycin CFormula:
C36H45O14NSmiles:
COC1C(OC2OC(C)C(O)C(C)(O)C2OC)c2c(cc3c(c2O)C(=O)c2c(ccc4c2OC2OC4(C)C(O)C(N(C)C)C2O)C3=O)CC1(C)OAglycone:
COC1C(O)c2c(cc3c(c2O)C(=O)c2c(ccc4c2OC2OC4(C)C(O)C(N(C)C)C2O)C3=O)CC1(C)OSugarmoiety:
COC1C(O)OC(C)C(O)C1(C)OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 7 |
| HBD: | 6 | FractionCSP3: | 0.61 |
| AlogP: | 0.04 | Num_rotatable_bonds: | 5 |
| MolWt: | 715.75 | Num_heavy_atoms: | 51 |
| TPSA: | 214.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD46962
Formula: C28H31O10N
Smiles:
COC1C(O)c2c(cc3c(c2O)C(=O)c2c(ccc4c2OC2OC4(C)C(O)C(N(C)C)C2O)C3=O)CC1(C)O| HBA: | 11 | RingCount: | 6 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | 0.14 | Num_rotatable_bonds: | 2 |
| MolWt: | 541.55 | Num_heavy_atoms: | 39 |
| TPSA: | 166.22 | NumAromaticRings: | 2 |
