Glycoside
GD003930
Name:
CALCIUM PANGAMATEFormula:
C10H18O8NSmiles:
CN(C)CC(=O)OC[C@H](O)[C@H](O)[C@H](O)[C@H](O)C(=O)[O-]Aglycone:
CN(C)CC=OSugarmoiety:
O=C(O)C(O)C(O)C(O)C(O)COOOther Identifiers
Properties
| HBA: | 9 | RingCount: | 0 |
| HBD: | 4 | FractionCSP3: | 0.8 |
| AlogP: | -4.72 | Num_rotatable_bonds: | 8 |
| MolWt: | 280.25 | Num_heavy_atoms: | 19 |
| TPSA: | 150.59 | NumAromaticRings: | 0 |
Unique Aglycone
AD03498
Formula: C4H9ON
Smiles:
CN(C)CC=O| HBA: | 2 | RingCount: | 0 |
| HBD: | 0 | FractionCSP3: | 0.75 |
| AlogP: | -0.25 | Num_rotatable_bonds: | 2 |
| MolWt: | 87.12 | Num_heavy_atoms: | 6 |
| TPSA: | 20.31 | NumAromaticRings: | 0 |
