(1S,3R,4R,5R)-3-[3,5-dihydroxy-4-(3,4,5-trihydroxybenzoyl)oxybenzoyl]oxy-1-hydroxy-4,5-bis[(3,4,5-trihydroxybenzoyl)oxy]cyclohexane-1-carboxylic acid

Names

[ CAS No. ]:
123166-69-8

[ Name ]:
(1S,3R,4R,5R)-3-[3,5-dihydroxy-4-(3,4,5-trihydroxybenzoyl)oxybenzoyl]oxy-1-hydroxy-4,5-bis[(3,4,5-trihydroxybenzoyl)oxy]cyclohexane-1-carboxylic acid

[Synonym ]:
3-O-Digalloyl-4,5-di-O-galloylquinic acid
3-DiG-4,5-GQA
Benzoic acid,3,5-dihydroxy-4-((3,4,5-trihydroxybenzoyl)oxy)-,5-carboxy-5-hydroxy-2,3-bis((3,4,5-trihydroxybenzoyl)oxy)cyclohexyl ester,(1R-(1alpha,2beta,3beta,5beta))
3,3,4,5-Tetragqa

Chemical & Physical Properties

[ Density]:
2.02g/cm3

[ Boiling Point ]:
1264.1ºC at 760mmHg

[ Molecular Formula ]:
C35H28O22

[ Molecular Weight ]:
800.58400

[ Flash Point ]:
394ºC

[ Exact Mass ]:
800.10700

[ PSA ]:
385.26000

[ LogP ]:
1.25350

[ Vapour Pressure ]:
0mmHg at 25°C

[ Index of Refraction ]:
1.852

Related Compounds

  • 4-Fluoro-2-isopropoxy-5-methylbenzaldehyde
  • 1-{4-[4-(propan-2-yl)-1H-pyrazol-1-yl]-1,3-thiazol-2-yl}ethan-1-one
  • 4-[(3R)-3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)pentanamido]-3-methyloxolane-3-carboxylic acid
  • 3-[(3R)-3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-N-methylpentanamido]oxolane-3-carboxylic acid
  • 1-[4-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-2-methylbut-2-enoyl]-3-methylpiperidine-3-carboxylic acid
  • (2R)-1-{2-[(1RS,2SR)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)cyclopentyl]acetyl}pyrrolidine-2-carboxylic acid
  • 2-{2-[2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)cyclopentyl]acetamido}hex-5-enoic acid
  • rac-2-{2-[(1R,2S)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)cyclopentyl]acetamido}pent-4-enoic acid
  • 1-{3-[({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)methyl]-1,2-oxazole-4-carbonyl}-3-methylpyrrolidine-3-carboxylic acid
  • 3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3-{methyl[(pyridazin-3-yl)methyl]carbamoyl}propanoic acid
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