Glycoside
GD039427
Name:
5-o-[(r)-{[(s)-[4-(8-amino-6-oxo-1,6-dihydro-9h-purin-9-yl)butoxy](hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]-alpha-d- ribofuranoseFormula:
C14H23O12N5P2Smiles:
Nc1nc2c(=O)[nH]cnc2n1CCCCOP(=O)(O)OP(=O)(O)OC[C@H]1O[C@H](O)[C@H](O)[C@@H]1OAglycone:
COP(=O)(O)OP(=O)(O)OCCCCn1c(N)nc2c(=O)[nH]cnc21Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 17 | RingCount: | 3 |
| HBD: | 8 | FractionCSP3: | 0.64 |
| AlogP: | -1.83 | Num_rotatable_bonds: | 11 |
| MolWt: | 515.31 | Num_heavy_atoms: | 33 |
| TPSA: | 261.8 | NumAromaticRings: | 2 |
Unique Aglycone
AD12744
Formula: C10H17O8N5P2
Smiles:
COP(=O)(O)OP(=O)(O)OCCCCn1c(N)nc2c(=O)[nH]cnc21| HBA: | 13 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | 0.36 | Num_rotatable_bonds: | 9 |
| MolWt: | 397.22 | Num_heavy_atoms: | 25 |
| TPSA: | 191.88 | NumAromaticRings: | 2 |
