Glycoside
GD154979
Name:
platencin a13Formula:
C30H39O11NSmiles:
C=C1CC23CCC(=O)C(C)(CCC(O)=Nc4c(OC5OC(CO)C(O)C(O)C5O)ccc(C(=O)O)c4O)C2CC1CC3Aglycone:
C=C1CC23CCC(=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: | 0.63 |
| AlogP: | 2.37 | Num_rotatable_bonds: | 8 |
| MolWt: | 589.64 | Num_heavy_atoms: | 42 |
| TPSA: | 206.57 | NumAromaticRings: | 1 |
Unique Aglycone
AD61513
Formula: C24H29O6N
Smiles:
C=C1CC23CCC(=O)C(C)(CCC(O)=Nc4c(O)ccc(C(=O)O)c4O)C2CC1CC3| HBA: | 7 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.54 |
| AlogP: | 4.9 | Num_rotatable_bonds: | 5 |
| MolWt: | 427.5 | Num_heavy_atoms: | 31 |
| TPSA: | 127.42 | NumAromaticRings: | 1 |
