6-O-Vanilloylajugol | CAS 124168-04-3 | AnyMole

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HIT214315649

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HIT214315649

HIT ID:HIT214315649
Cas No:124168-04-3
常用名:6-O-Vanilloylajugol
IUPAC:(1S,4aR,5R,7S,7aS)-7-hydroxy-7-methyl-1-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1H,4aH,5H,6H,7H,7aH-cyclopenta[c]pyran-5-yl 4-hydroxy-3-methoxybenzoate
IUPAC:(1S,4aR,5R,7S,7aS)-7-hydroxy-7-methyl-1-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1H,4aH,5H,6H,7H,7aH-cyclopenta[c]pyran-5-yl 4-hydroxy-3-methoxybenzoate
InChI key:PJAISAAYEQAVGA-YYFWYDPZSA-N

分子式:C23H30O12
分子量:498.481
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@@]12C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@]1([H])[C@@](C)(O)C[C@H]2OC(=O)c1ccc(O)c(OC)c1 |c:2|
SMILES:[H][C@@]12C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@]1([H])[C@@](C)(O)C[C@H]2OC(=O)c1ccc(O)c(OC)c1 |c:2|

6-O-Vanilloylajugol demonstrates scavenging properties toward the 2,2-diphenyl-1-picrylhydrazyl (DPPH) radical.

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¥ 3,750.00
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