Glycoside
GD124702
Name:
NoneFormula:
C27H39O14N2Smiles:
C=CC1C(OC2OC(CO)C(O)C(O)(O)C2OC[NH2+]C)OC=C(C(=O)OC)C1(O)C=CC1=CC(C(=O)O)=CN(CCO)C1Aglycone:
C=CC1C(O)OC=C(C(=O)OC)C1(O)C=CC1=CC(C(=O)O)=CN(CCO)C1Sugarmoiety:
C[NH2+]COC1C(O)OC(CO)C(O)C1(O)OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 3 |
| HBD: | 9 | FractionCSP3: | 0.56 |
| AlogP: | -4.0 | Num_rotatable_bonds: | 13 |
| MolWt: | 615.61 | Num_heavy_atoms: | 43 |
| TPSA: | 241.75 | NumAromaticRings: | 0 |
Unique Aglycone
AD50396
Formula: C19H23O8N
Smiles:
C=CC1C(O)OC=C(C(=O)OC)C1(O)C=CC1=CC(C(=O)O)=CN(CCO)C1| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.37 |
| AlogP: | -0.32 | Num_rotatable_bonds: | 7 |
| MolWt: | 393.39 | Num_heavy_atoms: | 28 |
| TPSA: | 136.76 | NumAromaticRings: | 0 |
