Glycoside
GD119642
Name:
NoneFormula:
C28H50O29N2P2Smiles:
NC1C(OP(=O)(O)O)OC(COC2OC(COC3(C(=O)O)CC(OC4(C(=O)O)CC(O)C(O)C(C(O)CO)O4)C(O)C(C(O)CO)O3)C(OP(=O)(O)O)C(O)C2N)C(O)C1OAglycone:
O=P(O)(O)O.O=P(O)(O)OSugarmoiety:
NC1C(O)OC(COC2OC(COC3(C(=O)O)CC(OC4(C(=O)O)CC(O)C(O)C(C(O)CO)O4)C(O)C(C(O)CO)O3)C(O)C(O)C2N)C(O)C1OOther Identifiers
Properties
| HBA: | 31 | RingCount: | 4 |
| HBD: | 20 | FractionCSP3: | 0.93 |
| AlogP: | -9.89 | Num_rotatable_bonds: | 18 |
| MolWt: | 940.64 | Num_heavy_atoms: | 61 |
| TPSA: | 527.07 | NumAromaticRings: | 0 |
Unique Aglycone
AD00019
Formula: H3O4P
Smiles:
O=P(O)(O)O| HBA: | 4 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | -0.93 | Num_rotatable_bonds: | 0 |
| MolWt: | 97.99 | Num_heavy_atoms: | 5 |
| TPSA: | 77.76 | NumAromaticRings: | 0 |
Sugarmoiety
SD04913
NC1C(O)OC(COC2OC(COC3(C(=O)O)CC(OC4(C(=O)O)CC(O)C(O)C(C(O)CO)O4)C(O)C(C(O)CO)O3)C(O)C(O)C2N)C(O)C1O