Glycoside
GD140555
Name:
platencin a12Formula:
C30H37O11NSmiles:
C=C1CC23C=CC(=O)C(C)(CCC(O)=Nc4c(OC5OC(CO)C(O)C(O)C5O)ccc(C(=O)O)c4O)C2CC1CC3Aglycone:
C=C1CC23C=CC(=O)C(C)(CCC(O)=Nc4c(O)ccc(C(=O)O)c4O)C2CC1CC3Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 6 |
| HBD: | 7 | FractionCSP3: | 0.57 |
| AlogP: | 2.15 | Num_rotatable_bonds: | 8 |
| MolWt: | 587.62 | Num_heavy_atoms: | 42 |
| TPSA: | 206.57 | NumAromaticRings: | 1 |
Unique Aglycone
AD56670
Formula: C24H27O6N
Smiles:
C=C1CC23C=CC(=O)C(C)(CCC(O)=Nc4c(O)ccc(C(=O)O)c4O)C2CC1CC3| HBA: | 7 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.46 |
| AlogP: | 4.67 | Num_rotatable_bonds: | 5 |
| MolWt: | 425.48 | Num_heavy_atoms: | 31 |
| TPSA: | 127.42 | NumAromaticRings: | 1 |
