Glycoside
GD149608
Name:
NoneFormula:
C29H40O14NSmiles:
C=CC1C(OC2OC(CO)C(O)C(O)(O)C2O)OC=C(C(=O)OC2CCCC2)C1(O)C=CC1=CC(C(=O)O)=C[NH+](CCO)C1Aglycone:
C=CC1C(O)OC=C(C(=O)OC2CCCC2)C1(O)C=CC1=CC(C(=O)O)=C[NH+](CCO)C1Sugarmoiety:
OCC1OC(O)C(O)C(O)(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 4 |
| HBD: | 9 | FractionCSP3: | 0.59 |
| AlogP: | -3.28 | Num_rotatable_bonds: | 11 |
| MolWt: | 626.63 | Num_heavy_atoms: | 44 |
| TPSA: | 237.34 | NumAromaticRings: | 0 |
Unique Aglycone
AD59809
Formula: C23H30O8N
Smiles:
C=CC1C(O)OC=C(C(=O)OC2CCCC2)C1(O)C=CC1=CC(C(=O)O)=C[NH+](CCO)C1| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.48 |
| AlogP: | -0.42 | Num_rotatable_bonds: | 8 |
| MolWt: | 448.49 | Num_heavy_atoms: | 32 |
| TPSA: | 137.96 | NumAromaticRings: | 0 |
