Glycoside
GD149901
Name:
Aabomycin AFormula:
C40H66O10Smiles:
CCC(=O)C(C)C(O)C(C)CC(C)C1OC(=O)CC2(O)CC=C(C)C(O2)C(C)=CCCCC(OC2CC(O)C(O)C(C)O2)C=CC(C)CC1CAglycone:
CCC(=O)C(C)C(O)C(C)CC(C)C1OC(=O)CC2(O)CC=C(C)C(O2)C(C)=CCCCC(O)C=CC(C)CC1CSugarmoiety:
CC1OC(O)CC(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.8 |
| AlogP: | 5.94 | Num_rotatable_bonds: | 9 |
| MolWt: | 706.96 | Num_heavy_atoms: | 50 |
| TPSA: | 151.98 | NumAromaticRings: | 0 |
Unique Aglycone
AD14897
Formula: C34H56O7
Smiles:
CCC(=O)C(C)C(O)C(C)CC(C)C1OC(=O)CC2(O)CC=C(C)C(O2)C(C)=CCCCC(O)C=CC(C)CC1C| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.76 |
| AlogP: | 6.06 | Num_rotatable_bonds: | 7 |
| MolWt: | 576.82 | Num_heavy_atoms: | 41 |
| TPSA: | 113.29 | NumAromaticRings: | 0 |
