Glycoside
GD125335
Name:
methyl 8-hydroxy-6-methyl-4-(propan-2-yl)-2,7-bis({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})naphthalene-1-carboxylateFormula:
C28H38O15Smiles:
COC(=O)c1c(OC2OC(CO)C(O)C(O)C2O)cc(C(C)C)c2cc(C)c(OC3OC(CO)C(O)C(O)C3O)c(O)c12Aglycone:
COC(=O)c1c(O)cc(C(C)C)c2cc(C)c(O)c(O)c12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 4 |
| HBD: | 9 | FractionCSP3: | 0.61 |
| AlogP: | -1.88 | Num_rotatable_bonds: | 8 |
| MolWt: | 614.6 | Num_heavy_atoms: | 43 |
| TPSA: | 245.29 | NumAromaticRings: | 2 |
Unique Aglycone
AD50687
Formula: C16H18O5
Smiles:
COC(=O)c1c(O)cc(C(C)C)c2cc(C)c(O)c(O)c12| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.31 |
| AlogP: | 3.18 | Num_rotatable_bonds: | 2 |
| MolWt: | 290.31 | Num_heavy_atoms: | 21 |
| TPSA: | 86.99 | NumAromaticRings: | 2 |
