Glycoside
GD126738
Name:
Platensimycin B4 Methyl EsterFormula:
C31H39O12NSmiles:
COC(=O)c1ccc(OC2OC(CO)C(O)C(O)C2O)c(N=C(O)CCC2(C)C(=O)C=CC34CC5CC(OC5(C)C3)C42)c1OAglycone:
COC(=O)c1ccc(O)c(N=C(O)CCC2(C)C(=O)C=CC34CC5CC(OC5(C)C3)C42)c1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 7 |
| HBD: | 6 | FractionCSP3: | 0.65 |
| AlogP: | 1.44 | Num_rotatable_bonds: | 8 |
| MolWt: | 617.65 | Num_heavy_atoms: | 44 |
| TPSA: | 204.8 | NumAromaticRings: | 1 |
Unique Aglycone
AD51297
Formula: C25H29O7N
Smiles:
COC(=O)c1ccc(O)c(N=C(O)CCC2(C)C(=O)C=CC34CC5CC(OC5(C)C3)C42)c1O| HBA: | 8 | RingCount: | 6 |
| HBD: | 3 | FractionCSP3: | 0.56 |
| AlogP: | 3.97 | Num_rotatable_bonds: | 5 |
| MolWt: | 455.51 | Num_heavy_atoms: | 33 |
| TPSA: | 125.65 | NumAromaticRings: | 1 |
