Glycoside
GD130666
Name:
3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2,3-dihydro-1,3-benzoxazol-2-oneFormula:
C13H15O7NSmiles:
O=c1oc2ccccc2n1C1OC(CO)C(O)C(O)C1OAglycone:
O=c1[nH]c2ccccc2o1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.46 |
| AlogP: | -1.43 | Num_rotatable_bonds: | 2 |
| MolWt: | 297.26 | Num_heavy_atoms: | 21 |
| TPSA: | 125.29 | NumAromaticRings: | 2 |
Unique Aglycone
AD52947
Formula: C7H5O2N
Smiles:
O=c1[nH]c2ccccc2o1| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 1.12 | Num_rotatable_bonds: | 0 |
| MolWt: | 135.12 | Num_heavy_atoms: | 10 |
| TPSA: | 46.0 | NumAromaticRings: | 2 |
