Glycoside
GD031247
Name:
NoneFormula:
C37H64O11N2SSmiles:
CCCCCCCCCCCCCCCCCCNC(=O)C1CSC([C@H](O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H](COC(C)=O)OC(C)=O)N1C(C)=OAglycone:
CCCCCCCCCCCCCCCCCCNC(=O)C1CSCN1C(C)=OSugarmoiety:
CC(=O)OCC(OC(C)=O)C(OC(C)=O)C(OC(C)=O)C(O)OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.84 |
| AlogP: | 5.37 | Num_rotatable_bonds: | 27 |
| MolWt: | 744.99 | Num_heavy_atoms: | 51 |
| TPSA: | 174.84 | NumAromaticRings: | 0 |
Unique Aglycone
AD20145
Formula: C24H46O2N2S
Smiles:
CCCCCCCCCCCCCCCCCCNC(=O)C1CSCN1C(C)=O| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.92 |
| AlogP: | 6.29 | Num_rotatable_bonds: | 18 |
| MolWt: | 426.71 | Num_heavy_atoms: | 29 |
| TPSA: | 49.41 | NumAromaticRings: | 0 |
