Glycoside
GD146795
Name:
N-[4,5-dihydroxy-6-(hydroxymethyl)-2-({6-oxo-6H,7H,8H,9H,10H-cyclohexa[c]chromen-3-yl}oxy)oxan-3-yl]acetamideFormula:
C21H25O8NSmiles:
CC(O)=NC1C(Oc2ccc3c4c(c(=O)oc3c2)CCCC4)OC(CO)C(O)C1OAglycone:
O=c1oc2cc(O)ccc2c2c1CCCC2Sugarmoiety:
CC(O)=NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.52 |
| AlogP: | 0.83 | Num_rotatable_bonds: | 4 |
| MolWt: | 419.43 | Num_heavy_atoms: | 30 |
| TPSA: | 141.95 | NumAromaticRings: | 2 |
Unique Aglycone
AD30272
Formula: C13H12O3
Smiles:
O=c1oc2cc(O)ccc2c2c1CCCC2| HBA: | 3 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.31 |
| AlogP: | 2.38 | Num_rotatable_bonds: | 0 |
| MolWt: | 216.24 | Num_heavy_atoms: | 16 |
| TPSA: | 50.44 | NumAromaticRings: | 2 |
