Glycoside
GD132388
Name:
methyl 3-(3-methylbut-2-en-1-yl)-1,4-bis({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})-1,4-dihydronaphthalene-2-carboxylateFormula:
C29H40O14Smiles:
COC(=O)C1=C(CC=C(C)C)C(OC2OC(CO)C(O)C(O)C2O)c2ccccc2C1OC1OC(CO)C(O)C(O)C1OAglycone:
COC(=O)C1=C(CC=C(C)C)C(O)c2ccccc2C1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.62 |
| AlogP: | -1.76 | Num_rotatable_bonds: | 9 |
| MolWt: | 612.63 | Num_heavy_atoms: | 43 |
| TPSA: | 225.06 | NumAromaticRings: | 1 |
Unique Aglycone
AD53599
Formula: C17H20O4
Smiles:
COC(=O)C1=C(CC=C(C)C)C(O)c2ccccc2C1O| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.35 |
| AlogP: | 2.59 | Num_rotatable_bonds: | 3 |
| MolWt: | 288.34 | Num_heavy_atoms: | 21 |
| TPSA: | 66.76 | NumAromaticRings: | 1 |
