Glycoside
GD013261
Name:
NoneFormula:
C17H25O6N3Smiles:
C=Cc1cn([C@@H]2O[C@H](C)[C@H](O)[C@H]2O)c(=O)nc1NC(=O)OCCCCCAglycone:
C=Cc1c[nH]c(=O)nc1NC(=O)OCCCCCSugarmoiety:
CC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.59 |
| AlogP: | 1.26 | Num_rotatable_bonds: | 7 |
| MolWt: | 367.4 | Num_heavy_atoms: | 26 |
| TPSA: | 122.91 | NumAromaticRings: | 1 |
Unique Aglycone
AD09918
Formula: C12H17O3N3
Smiles:
C=Cc1c[nH]c(=O)nc1NC(=O)OCCCCC| HBA: | 6 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.42 |
| AlogP: | 2.15 | Num_rotatable_bonds: | 6 |
| MolWt: | 251.29 | Num_heavy_atoms: | 18 |
| TPSA: | 84.08 | NumAromaticRings: | 1 |
