Glycoside
GD136113
Name:
ChattamycinFormula:
C34H44O15Smiles:
COC1CC(OC2C=C(C)CC3(O)C(OC(C)=O)C(O)C4C(=O)c5c(ccc(C6CC(O)C(O)C(C)O6)c5O)C(=O)C4C23O)OC(C)C1OAglycone:
CC(=O)OC1C(O)C2C(=O)c3c(ccc(C4CC(O)C(O)C(C)O4)c3O)C(=O)C2C2(O)C(O)C=C(C)CC12OSugarmoiety:
COC1CC(O)OC(C)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 6 |
| HBD: | 7 | FractionCSP3: | 0.68 |
| AlogP: | -0.41 | Num_rotatable_bonds: | 5 |
| MolWt: | 692.71 | Num_heavy_atoms: | 49 |
| TPSA: | 238.97 | NumAromaticRings: | 1 |
Unique Aglycone
AD46599
Formula: C27H32O12
Smiles:
CC(=O)OC1C(O)C2C(=O)c3c(ccc(C4CC(O)C(O)C(C)O4)c3O)C(=O)C2C2(O)C(O)C=C(C)CC12O| HBA: | 12 | RingCount: | 5 |
| HBD: | 7 | FractionCSP3: | 0.59 |
| AlogP: | -0.95 | Num_rotatable_bonds: | 2 |
| MolWt: | 548.54 | Num_heavy_atoms: | 39 |
| TPSA: | 211.28 | NumAromaticRings: | 1 |
