Glycoside
GD132938
Name:
StaphcoccomycinFormula:
C39H65O14NSmiles:
CCC1OC(=O)CC(O)C(C)C(OC2CC(N(C)C)C(O)C(C)O2)C(CC=O)CC(C)C(=O)C=CC2(C)OC2C1COC1OC(C)C(O)C(OC)C1OCAglycone:
CCC1OC(=O)CC(O)C(C)C(OC2CC(N(C)C)C(O)C(C)O2)C(CC=O)CC(C)C(=O)C=CC2(C)OC2C1COSugarmoiety:
COC1C(O)OC(C)C(O)C1OCOther Identifiers
Properties
| HBA: | 15 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.87 |
| AlogP: | 1.8 | Num_rotatable_bonds: | 11 |
| MolWt: | 771.94 | Num_heavy_atoms: | 54 |
| TPSA: | 192.28 | NumAromaticRings: | 0 |
Unique Aglycone
AD53504
Formula: C31H51O10N
Smiles:
CCC1OC(=O)CC(O)C(C)C(OC2CC(N(C)C)C(O)C(C)O2)C(CC=O)CC(C)C(=O)C=CC2(C)OC2C1CO| HBA: | 11 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.84 |
| AlogP: | 1.64 | Num_rotatable_bonds: | 7 |
| MolWt: | 597.75 | Num_heavy_atoms: | 42 |
| TPSA: | 155.36 | NumAromaticRings: | 0 |
