Glycoside
GD137040
Name:
Mycinamicin XviFormula:
C37H63O11NSmiles:
CCC1OC(=O)C=CC(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)CC(C)C(O)C=CC=CC1COC1OC(C)C(O)C(OC)C1OCAglycone:
CCC1OC(=O)C=CC(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)CC(C)C(O)C=CC=CC1COSugarmoiety:
COC1C(O)OC(C)C(O)C1OCOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.81 |
| AlogP: | 3.23 | Num_rotatable_bonds: | 9 |
| MolWt: | 697.91 | Num_heavy_atoms: | 49 |
| TPSA: | 145.61 | NumAromaticRings: | 0 |
Unique Aglycone
AD55382
Formula: C29H49O7N
Smiles:
CCC1OC(=O)C=CC(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)CC(C)C(O)C=CC=CC1CO| HBA: | 8 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.76 |
| AlogP: | 3.07 | Num_rotatable_bonds: | 5 |
| MolWt: | 523.71 | Num_heavy_atoms: | 37 |
| TPSA: | 108.69 | NumAromaticRings: | 0 |
