Glycoside
GD074376
Name:
NoneFormula:
C15H25O6N3SSmiles:
CCNC(=S)N1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@H]1OAglycone:
CCNC(=S)N1CC2CCC(C1)N2C=OSugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.87 |
| AlogP: | -2.64 | Num_rotatable_bonds: | 2 |
| MolWt: | 375.45 | Num_heavy_atoms: | 25 |
| TPSA: | 125.73 | NumAromaticRings: | 0 |
Unique Aglycone
AD34378
Formula: C10H17ON3S
Smiles:
CCNC(=S)N1CC2CCC(C1)N2C=O| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.8 |
| AlogP: | 0.19 | Num_rotatable_bonds: | 2 |
| MolWt: | 227.33 | Num_heavy_atoms: | 15 |
| TPSA: | 35.58 | NumAromaticRings: | 0 |
