Glycoside
GD007712
Name:
NoneFormula:
C32H51O17N10PSmiles:
NC[C@@H]1O[C@H](O[C@@H]2[C@H](N)C[C@H](N)[C@H](O)[C@H]2NCCNC(=O)[C@@H]2O[C@H](n3ccc(=O)[nH]c3=O)C[C@H]2OP(=O)(O)OC[C@@H]2O[C@H](n3ccc(=O)[nH]c3=O)C[C@H]2O)[C@H](N)[C@H](O)[C@H]1OAglycone:
NC1CC(N)C(O)C(NCCNC(=O)C2OC(n3ccc(=O)[nH]c3=O)CC2OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)CC2O)C1OSugarmoiety:
NCC1OC(O)C(N)C(O)C1OOther Identifiers
Properties
| HBA: | 27 | RingCount: | 6 |
| HBD: | 17 | FractionCSP3: | 0.72 |
| AlogP: | -7.86 | Num_rotatable_bonds: | 15 |
| MolWt: | 878.79 | Num_heavy_atoms: | 60 |
| TPSA: | 428.53 | NumAromaticRings: | 2 |
Unique Aglycone
AD06253
Formula: C26H39O14N8P
Smiles:
NC1CC(N)C(O)C(NCCNC(=O)C2OC(n3ccc(=O)[nH]c3=O)CC2OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)CC2O)C1O| HBA: | 22 | RingCount: | 5 |
| HBD: | 12 | FractionCSP3: | 0.65 |
| AlogP: | -5.62 | Num_rotatable_bonds: | 12 |
| MolWt: | 718.61 | Num_heavy_atoms: | 49 |
| TPSA: | 337.8 | NumAromaticRings: | 2 |
