Chemical Compound

Cyclohexanecarboxylic acid, 3,5-bis[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-1,4-dihydroxy-, (1a,3R,4a,5R)-; Cinnamic acid, 3,4-dihydroxy-, 5-carboxy-2,5-dihydroxy-1,3-cyclohexylene ester (8CI); Cyclohexanecarboxylic acid, 3,5-bis[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1,4-dihydroxy-, (1a,3R,4a,5R)- (9CI); Cyclohexanecarboxylic acid, 3,5-bis[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1,4-dihydroxy-, [1R-(1a,3a,4a,5ss)]-; Cyclohexanecarboxylic acid, 1,3,4,5-tetrahydroxy-, 3,5-bis(3,4-dihydroxycinnamate) (8CI); (1a,3R,4a,5R)-3,5-Bis[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-1,4-dihydroxycyclohexanecarboxylic acid; 3,5-Dicaffeoylquinic acid; 3,5-Dicaffeylquinic acid; CJ 4-16-4; Isochlorogenic acid a; Quinic acid 3,5-di-O-caffeate

CAS Registry Number 2450-53-5
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Cyclohexanecarboxylic acid, 3,5-bis[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-1,4-dihydroxy-, (1a,3R,4a,5R)-; Cinnamic acid, 3,4-dihydroxy-, 5-carboxy-2,5-dihydroxy-1,3-cyclohexylene ester (8CI); Cyclohexanecarboxylic acid, 3,5-bis[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1,4-dihydroxy-, (1a,3R,4a,5R)- (9CI); Cyclohexanecarboxylic acid, 3,5-bis[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1,4-dihydroxy-, [1R-(1a,3a,4a,5ss)]-; Cyclohexanecarboxylic acid, 1,3,4,5-tetrahydroxy-, 3,5-bis(3,4-dihydroxycinnamate) (8CI); (1a,3R,4a,5R)-3,5-Bis[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-1,4-dihydroxycyclohexanecarboxylic acid; 3,5-Dicaffeoylquinic acid; 3,5-Dicaffeylquinic acid; CJ 4-16-4; Isochlorogenic acid a; Quinic acid 3,5-di-O-caffeate 结构式
Primary record

Cyclohexanecarboxylic acid, 3,5-bis[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-1,4-dihydroxy-, (1a,3R,4a,5R)-; Cinnamic acid, 3,4-dihydroxy-, 5-carboxy-2,5-dihydroxy-1,3-cyclohexylene ester (8CI); Cyclohexanecarboxylic acid, 3,5-bis[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1,4-dihydroxy-, (1a,3R,4a,5R)- (9CI); Cyclohexanecarboxylic acid, 3,5-bis[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1,4-dihydroxy-, [1R-(1a,3a,4a,5ss)]-; Cyclohexanecarboxylic acid, 1,3,4,5-tetrahydroxy-, 3,5-bis(3,4-dihydroxycinnamate) (8CI); (1a,3R,4a,5R)-3,5-Bis[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-1,4-dihydroxycyclohexanecarboxylic acid; 3,5-Dicaffeoylquinic acid; 3,5-Dicaffeylquinic acid; CJ 4-16-4; Isochlorogenic acid a; Quinic acid 3,5-di-O-caffeate

库存
3,757 克
纯度
98.4 %
CAS
2450-53-5

化合物标识与属性

CAS
2450-53-5
PubChem CID
6474310
SMILES
C1C(C[C@H](C([C@@H]1OC(=O)/C=C/C2=CC(=C(C=C2)O)O)O)OC(=O)/C=C/C3=CC(=C(C=C3)O)O)(O)C(=O)O
Canonical SMILES
O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1CC(O)(C(=O)O)C[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)C1O

名称与同义词

  • Isochlorogenic acid A
  • 3,5-Dicaffeoylquinic acid
  • 3,5-Di-O-caffeoylquinic acid
  • 3,5-Dicaffeoyl-epi-quinic acid
  • Isochlorogenic acid
  • 2450-53-5
  • IsochlorogenicacidA
  • caffeoylquinic acid
  • 3,5-dicaffeoylquinate
  • 89919-62-0
  • Dicaffeoylquinic acid
  • Isochlorogenic-acid-A
  • 3,5-DCQA
  • 3,5-O-dicaffeoylquinic acid
  • Methylhydrogenphthalate
  • Isochlorogenic acid II
  • Quinic acid 3,5-di-O-caffeate
  • 3,5-dicaffeoyl quinic acid
  • 3,5-Dicaffeoylquinicacid
  • 3,5-Dicaffeoylquininic acid
  • 3,5-dicaffeylquinic acid
  • (E,E)-3,5-Di-O-caffeoylquinic acid
  • RefChem:1087527
  • 3,5-DICQA
  • CHEMBL249447
  • ND94C5E75K
  • 3,5-Di-caffeoylquinic acid
  • 3,5-O-dicaffeoylquinc acid
  • UNII-ND94C5E75K
  • 3,5-di-O-caffeoyl quinic acid
  • CHEMBL4289566
  • DTXSID00424282
  • 3,5-di-O-Aaffeoylquinic acid
  • 3,5-di-O-caffeoyl quinicacid
  • 3,5-O-di-caffeoylquinic acid
  • 3,5-O-dicaffeoyl quinic acid
  • 3,5-O-dicaffeoyl-quinic acid
  • MFCD00951290
  • (-)-3,5-Dicaffeoyl quinic acid
  • AC1O6F94
  • orb1297662
  • orb1302093
  • orb1984251
  • 3',5'-O-dicaffeoylquinic acid
  • CHEMBL4466054
  • SCHEMBL13567304
  • SCHEMBL20339739
  • SCHEMBL29383395
  • (-)-3,5-Dicaffeoylquinic acid
  • 3,5-Di-trans-caffeoylquinicacid
  • ACon1_002290
  • CHEBI:65751
  • GTPL12548
  • HY-N0056R
  • 879305-14-3
  • Isochlorogenic acid A (Standard)
  • C25H24O12
  • AIDS028062
  • DTXCID201784863
  • DTXSID501371778
  • HMS6018F04
  • Trans 3,5-O-dicaffeoylquinic acid
  • HY-N0056
  • HY-N9895
  • MSK40155
  • ZINC3919243
  • CJ-4-16-4
  • BDBM50362839
  • BDBM50466107
  • MFCD23843780
  • s9282
  • (E,E)-3,5-O-dicaffeoylquinic acid
  • AKOS015903388
  • AKOS016007890
  • AKOS032948323
  • ZINC100037586
  • ZINC100051019
  • ACN-035249
  • CCG-269821
  • CID6474310
  • CJ 4-16-4
  • CS-3768
  • EBC-616764
  • EBC-617621
  • FD41813
  • NCGC00169984-01
  • NCGC00169984-03
  • NCGC00390251-01
  • 3,5-H56:H75dicaffeoyl-epi-quinic acid
  • 4CN-0985
  • AJ-94577
  • BC245601
  • BS-42212
  • DA-49507
  • DA-60222
  • DA-74544
  • PD197614
  • SY074416
  • (1S,3R,4S,5R)-3,5-Bis(((E)-3-(3,4-dihydroxyphenyl)acryloyl)oxy)-1,4-dihydroxycyclohexanecarboxylic acid
  • 3,5-DI-O-(E)-CAFFEOYLQUINIC ACID
  • AB0020622
  • J441.723B
  • J749.366E
  • CS-0204164
  • FT-0777546
  • FT-0777797
  • V1570
  • J1.453.981F
  • J2.301.841A
  • J3.381.958G
  • 3,5-Di-o-caffeoylquinic acid/Isochlorogenic acid A
  • A12072
  • C22991
  • (3R,5R)-3,5-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1,4-dihydroxycyclohexane-1-carboxylic acid
  • 450I535
  • A1205491
  • 3,5-Di-caffeoylquinic acid, >=95% (LC/MS-ELSD)
  • I14-18638
  • Q27134233
  • (3R,5R)-3,5-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1,4-dihydroxy-cyclohexanecarboxylic acid
  • (1alpha,3R,4alpha,5R)-3,5-Bis(((E)-3-(3,4-dihydroxyphenyl)acryloyl)oxy)-1,4-dihydroxycyclohexanecarboxylic acid
  • (1S,3R,4S,5R)-1,3,4,5-tetrahydroxy-1-carboxycyclohexane3,5-di-3-(3,4-dihydroxyphenyl)propenoate
  • (3R,5R)-3,5-bis{[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-1,4-dihydroxycyclohexanecarboxylic acid
  • 3beta,5alpha-Bis(3,4-dihydroxycinnamoyloxy)-1,4alpha-dihydroxycyclohexanecarboxylic acid
  • (1.ALPHA.,3R,4.ALPHA.,5R)-3,5-BIS(((2E)-3-(3,4-DIHYDROXYPHENYL)-1-OXO-2-PROPEN-1-YL)OXY)-1,4-DIHYDROXYCYCLOHEXANECARBOXYLIC ACID
  • (1|A,3R,4|A,5R)-3,5-Bis(((E)-3-(3,4-dihydroxyphenyl)acryloyl)oxy)-1,4-dihydroxycyclohexanecarboxylic acid
  • (1R)-1beta,3alpha-Bis[[(E)-1-oxo-3-(3,4-dihydroxyphenyl)-2-propenyl]oxy]-2beta,5-dihydroxy-5alpha-cyclohexanecarboxylic acid
  • (1R,3R,4R,5R)-3,5-Bis(((E)-3-(3,4-dihydroxyphenyl)acryloyl)oxy)-1,4-dihydroxycyclohexane-1-carboxylic acid
  • (1S,3R,4R,5R)-3,5-Bis[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]-1,4-dihydroxycyclohexanecarboxylic acid
  • (1S,3R,4S,5R)-3,5-Bis(((E)-3-(3,4-dihydroxyphenyl)acryloyl)oxy)-1,4-dihydroxycyclohexanecarboxylicacid
  • (1S,3R,4S,5R)-3,5-BIS(((E)-3-(3,4-DIHYDROXYPHENYL)ACRYLOYL)OXY)-1,5-DIHYDROXYCYCLOHEXANE-1-CARBOXYLIC ACID
  • (1S,3R,4S,5R)-3,5-BIS({[(2E)-3-(3,4-DIHYDROXYPHENYL)PROP-2-ENOYL]OXY})-1,4-DIHYDROXYCYCLOHEXANE-1-CARBOXYLIC ACID
  • (1S,3R,4S,5R)-3,5-Bis{[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-1,4-dihydroxycyclohexane-1-carboxylic acid
  • (3R,5R)-3,5-bis(((2E)-3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl))-1,4-dihydroxy-cyclohexanecarboxylic acid
  • (3R,5R)-3,5-bis(((E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl)oxy)-1,4-dihydroxycyclohexane-1-carboxylic acid
  • (3R,5R)-3,5-BIS({[(2E)-3-(3,4-DIHYDROXYPHENYL)PROP-2-ENOYL]OXY})-1,4-DIHYDROXYCYCLOHEXANE-1-CARBOXYLIC ACID
  • (3R,5R)-3,5-Bis{[(2E)-3-(3,4-dihydroxyphenyl)-2-propenoyl]oxy}-1,4-dihydroxycyclohexanecarboxylic acid
  • 1,4alpha-Dihydroxy-3beta,5alpha-bis(3,4-dihydroxy-trans-cinnamoyloxy)cyclohexane-1beta-carboxylic acid
  • 1,4alpha-Dihydroxy-3beta,5alpha-bis(3,4-dihydroxycinnamoyloxy)-1beta-cyclohexanecarboxylic acid
  • 1,4alpha-Dihydroxy-3beta,5alpha-bis(3,4-dihydroxycinnamoyloxy)cyclohexane-1beta-carboxylic acid
  • 1,4alpha-Dihydroxy-3beta,5alpha-bis[(3,4-dihydroxy-trans-cinnamoyl)oxy]-1beta-cyclohexanecarboxylic acid
  • 1,4alpha-Dihydroxy-3beta,5alpha-bis[[(E)-3-(3,4-dihydroxyphenyl)acryloyl]oxy]-1beta-cyclohexanecarboxylic acid
  • 1,4beta-Dihydroxy-3beta,5alpha-bis(3,4-dihydroxy-trans-cinnamoyloxy)-1alpha-cyclohexanecarboxylic acid
  • 1,4beta-Dihydroxy-3beta,5alpha-bis[3-(3,4-dihydroxyphenyl)acryloyloxy]cyclohexane-1beta-carboxylic acid
  • 1-Hydroxy-3beta,5alpha-bis[(E)-3,4-dihydroxycinnamoyloxy]-4alpha-hydroxycyclohexane-1beta-carboxylic acid
  • 1alpha,4alpha-Dihydroxy-3beta,5alpha-bis(3,4-dihydroxycinnamoyloxy)-1-cyclohexanecarboxylic acid
  • 1alpha,4alpha-Dihydroxy-3beta,5alpha-bis[3-(3,4-dihydroxyphenyl)propenoyloxy]cyclohexanecarboxylic acid
  • 1beta,4beta-Dihydroxy-3beta,5alpha-bis[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1alpha-cyclohexanecarboxylic acid
  • 1beta,4beta-Dihydroxy-3beta,5alpha-bis[3-(3,4-dihydroxyphenyl)acryloyloxy]cyclohexane-1-carboxylic acid
  • 1beta,4beta-Dihydroxy-3beta,5alpha-bis[3-(3,4-dihydroxyphenyl)propenoyloxy]cyclohexanecarboxylic acid
  • 3beta,5alpha-Bis[(E)-3-(3,4-dihydroxyphenyl)acryloyloxy]-1,4alpha-dihydroxycyclohexane-1beta-carboxylic acid
  • 3beta,5alpha-Bis[[(E)-3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1,4alpha-dihydroxy-1beta-cyclohexanecarboxylic acid
  • 3beta,5alpha-Bis[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1beta,4beta-dihydroxycyclohexanecarboxylic acid
  • 3beta,5alpha-Bis[3-(3,4-dihydroxyphenyl)acryloyloxy]-1,4alpha-dihydroxycyclohexane-1beta-carboxylic acid
  • 3beta,5alpha-Bis[3-(3,4-dihydroxyphenyl)propenoyloxy]-1alpha,4alpha-dihydroxycyclohexanecarboxylic acid
  • 815-082-0
  • CYCLOHEXANECARBOXYLIC ACID, 1,4-DIHYDROXY-3,5-BIS(((2E)-3-(4-HYDROXYPHENYL)-1-OXO-2-PROPEN-1-YL)OXY)-, (1.ALPHA.,3R,4.ALPHA.,5R)-
  • CYCLOHEXANECARBOXYLIC ACID, 3,5-BIS(((2E)-3-(3,4-DIHYDROXYPHENYL)-1-OXO-2-PROPEN-1-YL)OXY)-1,4-DIHYDROXY-, (1.ALPHA.,3R,4.ALPHA.,5R)-
  • CYCLOHEXANECARBOXYLIC ACID, 3,5-BIS((3-(3,4-DIHYDROXYPHENYL)-1-OXO-2-PROPENYL)OXY)-1,4-DIHYDROXY-, (1R-(1.ALPHA.,3.ALPHA.(E),4.ALPHA.,5.BETA.(E)))-
  • Cyclohexanecarboxylic acid, 3,5-bis[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-1,4-dihydroxy-, (1a,3R,4a,5R)-; Cinnamic acid, 3,4-dihydroxy-, 5-carboxy-2,5-dihydroxy-1,3-cyclohexylene ester (8CI); Cyclohexanecarboxylic acid, 3,5-bis[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1,4-dihydroxy-, (1a,3R,4a,5R)- (9CI); Cyclohexanecarboxylic acid, 3,5-bis[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1,4-dihydroxy-, [1R-(1a,3a,4a,5ss)]-; Cyclohexanecarboxylic acid, 1,3,4,5-tetrahydroxy-, 3,5-bis(3,4-dihydroxycinnamate) (8CI); (1a,3R,4a,5R)-3,5-Bis[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-1,4-dihydroxycyclohexanecarboxylic acid; 3,5-Dicaffeoylquinic acid; 3,5-Dicaffeylquinic acid; CJ 4-16-4; Isochlorogenic acid a; Quinic acid 3,5-di-O-caffeate