Glycoside
GD035182
Name:
NoneFormula:
C24H33O8N3Smiles:
CC1=CCC[C@]2(C)O[C@H]2[C@@H]2OC(=O)C(CNc3ccn(C4OC(CO)[C@H](O)[C@H]4O)c(=O)n3)[C@H]2CC1Aglycone:
CC1=CCCC2(C)OC2C2OC(=O)C(CNc3cc[nH]c(=O)n3)C2CC1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.71 |
| AlogP: | 0.1 | Num_rotatable_bonds: | 5 |
| MolWt: | 491.54 | Num_heavy_atoms: | 35 |
| TPSA: | 155.67 | NumAromaticRings: | 1 |
Unique Aglycone
AD20331
Formula: C19H25O4N3
Smiles:
CC1=CCCC2(C)OC2C2OC(=O)C(CNc3cc[nH]c(=O)n3)C2CC1| HBA: | 7 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.63 |
| AlogP: | 2.02 | Num_rotatable_bonds: | 3 |
| MolWt: | 359.43 | Num_heavy_atoms: | 26 |
| TPSA: | 96.61 | NumAromaticRings: | 1 |
