Glycoside
GD134449
Name:
Mycinamicin XivFormula:
C36H59O12NSmiles:
CCC1OC(=O)C=CCC(OC2OC(C)CC(N(C)C)C2O)C(C)CC(C)C(=O)C=CC=CC1(O)COC1OC(C)C(O)C(OC)C1OCAglycone:
CCC1OC(=O)C=CCC(OC2OC(C)CC(N(C)C)C2O)C(C)CC(C)C(=O)C=CC=CC1(O)COSugarmoiety:
COC1C(O)OC(C)C(O)C1OCOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.78 |
| AlogP: | 2.31 | Num_rotatable_bonds: | 9 |
| MolWt: | 697.86 | Num_heavy_atoms: | 49 |
| TPSA: | 162.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD54388
Formula: C28H45O8N
Smiles:
CCC1OC(=O)C=CCC(OC2OC(C)CC(N(C)C)C2O)C(C)CC(C)C(=O)C=CC=CC1(O)CO| HBA: | 9 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.71 |
| AlogP: | 2.15 | Num_rotatable_bonds: | 5 |
| MolWt: | 523.67 | Num_heavy_atoms: | 37 |
| TPSA: | 125.76 | NumAromaticRings: | 0 |
