Glycoside
GD118747
Name:
Sporeamicin BFormula:
C36H61O12NSmiles:
CCC1OC(=O)C(C)C(OC2CC(C)(O)C(O)C(C)O2)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)C2=C(C)C(=O)C1(C)O2Aglycone:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)C2=C(C)C(=O)C1(C)O2Sugarmoiety:
CC1OC(O)CC(C)(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.89 |
| AlogP: | 2.45 | Num_rotatable_bonds: | 6 |
| MolWt: | 699.88 | Num_heavy_atoms: | 49 |
| TPSA: | 173.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD47509
Formula: C29H49O9N
Smiles:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)C2=C(C)C(=O)C1(C)O2| HBA: | 10 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.86 |
| AlogP: | 2.18 | Num_rotatable_bonds: | 4 |
| MolWt: | 555.71 | Num_heavy_atoms: | 39 |
| TPSA: | 134.99 | NumAromaticRings: | 0 |
