Glycoside
GD013483
Name:
NoneFormula:
C12H14O3N3SISmiles:
CSc1ncnc2c1c(I)cn2C1O[C@H](C)[C@H](O)[C@H]1OAglycone:
CSc1ncnc2c1C(I)=C[N]2Sugarmoiety:
CC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 1.4 | Num_rotatable_bonds: | 2 |
| MolWt: | 407.23 | Num_heavy_atoms: | 20 |
| TPSA: | 80.4 | NumAromaticRings: | 2 |
Unique Aglycone
AD07430
Formula: C7H5N3SI
Smiles:
CSc1ncnc2c1C(I)=C[N]2| HBA: | 3 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.14 |
| AlogP: | 2.18 | Num_rotatable_bonds: | 1 |
| MolWt: | 290.11 | Num_heavy_atoms: | 12 |
| TPSA: | 39.88 | NumAromaticRings: | 1 |
