Glycoside
GD127281
Name:
Platensimycin B4Formula:
C30H37O12NSmiles:
CC12CC34C=CC(=O)C(C)(CCC(O)=Nc5c(OC6OC(CO)C(O)C(O)C6O)ccc(C(=O)O)c5O)C3C(CC1C4)O2Aglycone:
CC12CC34C=CC(=O)C(C)(CCC(O)=Nc5c(O)ccc(C(=O)O)c5O)C3C(CC1C4)O2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 7 |
| HBD: | 7 | FractionCSP3: | 0.63 |
| AlogP: | 1.36 | Num_rotatable_bonds: | 8 |
| MolWt: | 603.62 | Num_heavy_atoms: | 43 |
| TPSA: | 215.8 | NumAromaticRings: | 1 |
Unique Aglycone
AD51539
Formula: C24H27O7N
Smiles:
CC12CC34C=CC(=O)C(C)(CCC(O)=Nc5c(O)ccc(C(=O)O)c5O)C3C(CC1C4)O2| HBA: | 8 | RingCount: | 6 |
| HBD: | 4 | FractionCSP3: | 0.54 |
| AlogP: | 3.88 | Num_rotatable_bonds: | 5 |
| MolWt: | 441.48 | Num_heavy_atoms: | 32 |
| TPSA: | 136.65 | NumAromaticRings: | 1 |
