Glycoside
GD084512
Name:
NoneFormula:
C17H27O6N3SSmiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2csc(N3CCCCC3)n2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(NCCO)c1csc(N2CCCCC2)n1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.76 |
| AlogP: | -0.29 | Num_rotatable_bonds: | 6 |
| MolWt: | 401.49 | Num_heavy_atoms: | 27 |
| TPSA: | 124.38 | NumAromaticRings: | 1 |
Unique Aglycone
AD37752
Formula: C11H17O2N3S
Smiles:
O=C(NCCO)c1csc(N2CCCCC2)n1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.64 |
| AlogP: | 0.86 | Num_rotatable_bonds: | 4 |
| MolWt: | 255.34 | Num_heavy_atoms: | 17 |
| TPSA: | 65.46 | NumAromaticRings: | 1 |
