Glycoside
GD077327
Name:
3-methyl-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-6H,7H,8H,9H,10H-cyclohexa[c]chromen-6-oneFormula:
C20H24O8Smiles:
Cc1cc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c2c3c(c(=O)oc2c1)CCCC3Aglycone:
Cc1cc(O)c2c3c(c(=O)oc2c1)CCCC3Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.55 |
| AlogP: | 0.16 | Num_rotatable_bonds: | 3 |
| MolWt: | 392.4 | Num_heavy_atoms: | 28 |
| TPSA: | 129.59 | NumAromaticRings: | 2 |
Unique Aglycone
AD35485
Formula: C14H14O3
Smiles:
Cc1cc(O)c2c3c(c(=O)oc2c1)CCCC3| HBA: | 3 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.36 |
| AlogP: | 2.69 | Num_rotatable_bonds: | 0 |
| MolWt: | 230.26 | Num_heavy_atoms: | 17 |
| TPSA: | 50.44 | NumAromaticRings: | 2 |
