Glycoside
GD117317
Name:
2-({7,10-dihydroxy-1,3-dimethyl-1H,3H,4H-naphtho[2,3-c]pyran-9-yl}oxy)-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C21H26O9Smiles:
CC1Cc2cc3cc(O)cc(OC4OC(CO)C(O)C(O)C4O)c3c(O)c2C(C)O1Aglycone:
CC1Cc2cc3cc(O)cc(O)c3c(O)c2C(C)O1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.52 |
| AlogP: | 0.45 | Num_rotatable_bonds: | 3 |
| MolWt: | 422.43 | Num_heavy_atoms: | 30 |
| TPSA: | 149.07 | NumAromaticRings: | 2 |
Unique Aglycone
AD46758
Formula: C15H16O4
Smiles:
CC1Cc2cc3cc(O)cc(O)c3c(O)c2C(C)O1| HBA: | 4 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.33 |
| AlogP: | 2.98 | Num_rotatable_bonds: | 0 |
| MolWt: | 260.29 | Num_heavy_atoms: | 19 |
| TPSA: | 69.92 | NumAromaticRings: | 2 |
