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Coumaric acids and derivatives
Description:
Aromatic compounds containing Aromatic compounds containing a cinnamic acid moiety (or a derivative thereof) hydroxylated at the C2 (ortho-), C3 (meta-), or C4 (para-) carbon atom of the benzene ring.
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Coniferyl ferulateCas Number: 63644-62-2Formula: C20H20O6 Molecular Weight: 356.38IUPAC Name: [(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enyl] (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoateSMILES: COC1=C(C=CC(=C1)C=CCOC(=O)C=CC2=CC(=C(C=C2)O)OC)OInChIKey: PGLIMMMHQDNVRS-YZQQHVNFSA-NInChI: InChI=1S/C20H20O6/c1-24-18-12-14(5-8-16(18)21)4-3-11-26-20(23)10-7-15-6-9-17(22)19(13-15)25-2/h3-10,12-13,21-22H,11H2,1-2H3/b4-3+,10-7+Synonyms: MS-25579 | SCHEMBL10054940 | 3-(4-Hydroxy-3-methoxyphenyl)allyl 3-(4-hydroxy-3-methoxyphenyl)acrylate | BDBM50185689 ...
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Caftaric AcidCas Number: 67879-58-7Formula: C13H12O9 Molecular Weight: 312.23IUPAC Name: (2R,3R)-2-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-3-hydroxybutanedioic acidSMILES: C1=CC(=C(C=C1C=CC(=O)OC(C(C(=O)O)O)C(=O)O)O)OInChIKey: SWGKAHCIOQPKFW-JTNORFRNSA-NInChI: InChI=1S/C13H12O9/c14-7-3-1-6(5-8(7)15)2-4-9(16)22-11(13(20)21)10(17)12(18)19/h1-5,10-11,14-15,17H,(H,18,19)(H,20,21)/b4-2+/t10-,11-/m1/s1Synonyms: Caftaric acid , HPLC Grade | Q-100761 | Caftaric acid, analytical standard | Butanedioic acid, 2-(((2E)-3-(3,4-dihydr...
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Calceolarioside BCas Number: 105471-98-5Formula: C23H26O11 Molecular Weight: 478.46IUPAC Name: [(2R,3S,4S,5R,6R)-6-[2-(3,4-dihydroxyphenyl)ethoxy]-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoateSMILES: C1=CC(=C(C=C1CCOC2C(C(C(C(O2)COC(=O)C=CC3=CC(=C(C=C3)O)O)O)O)O)O)OInChIKey: LFKQVVDFNHDYNK-FOXCETOMSA-NInChI: show moreSynonyms: b-D-Glucopyranoside,2-(3,4-dihydroxyphenyl)ethyl, 6-[(2E)-3-(3,4-dihydroxyphenyl)-2-propenoate];Calceolarioside B | M...
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Calceolarioside BCas Number: 105471-98-5Formula: C23H26O11 Molecular Weight: 478.46IUPAC Name: [(2R,3S,4S,5R,6R)-6-[2-(3,4-dihydroxyphenyl)ethoxy]-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoateSMILES: C1=CC(=C(C=C1CCOC2C(C(C(C(O2)COC(=O)C=CC3=CC(=C(C=C3)O)O)O)O)O)O)OInChIKey: LFKQVVDFNHDYNK-FOXCETOMSA-NInChI: show moreSynonyms: Calceolarioside B|105471-98-5|Desrhamnosyl isoacteoside|[(2R,3S,4S,5R,6R)-6-[2-(3,4-dihydroxyphenyl)ethoxy]-3,4,5-tri...
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Caffeic acid phenethyl esterCas Number: 104594-70-9Formula: C17H16O4 Molecular Weight: 284.31IUPAC Name: 2-phenylethyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoateSMILES: C1=CC=C(C=C1)CCOC(=O)C=CC2=CC(=C(C=C2)O)OInChIKey: SWUARLUWKZWEBQ-VQHVLOKHSA-NInChI: InChI=1S/C17H16O4/c18-15-8-6-14(12-16(15)19)7-9-17(20)21-11-10-13-4-2-1-3-5-13/h1-9,12,18-19H,10-11H2/b9-7+Synonyms: Caffeic acid phenethyl ester|Phenethyl caffeate|104594-70-9|CAPE|Phenylethyl caffeate|115610-29-2|phenethyl 3-(3,4-di...
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Caftaric AcidCas Number: 67879-58-7Formula: C13H12O9 Molecular Weight: 312.23IUPAC Name: (2R,3R)-2-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-3-hydroxybutanedioic acidSMILES: C1=CC(=C(C=C1C=CC(=O)OC(C(C(=O)O)O)C(=O)O)O)OInChIKey: SWGKAHCIOQPKFW-JTNORFRNSA-NInChI: InChI=1S/C13H12O9/c14-7-3-1-6(5-8(7)15)2-4-9(16)22-11(13(20)21)10(17)12(18)19/h1-5,10-11,14-15,17H,(H,18,19)(H,20,21)/b4-2+/t10-,11-/m1/s1Synonyms: caftaric acid|67879-58-7|trans-caftaric acid|CAFFEOYLTARTARICACID|(2R,3R)-2-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]...
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CDCCas Number: 132465-11-3Formula: C19H15NO4 Molecular Weight: 321.33IUPAC Name: [(E)-3-phenylprop-2-enyl] (E)-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enoateSMILES: C1=CC=C(C=C1)C=CCOC(=O)C(=CC2=CC(=C(C=C2)O)O)C#NInChIKey: XGHYFEJMJXGPGN-UYHGDYIZSA-NInChI: InChI=1S/C19H15NO4/c20-13-16(11-15-8-9-17(21)18(22)12-15)19(23)24-10-4-7-14-5-2-1-3-6-14/h1-9,11-12,21-22H,10H2/b7-4+,16-11+Synonyms: A-cyanocinnamate | CINNAMYL-3,4-DIHYDROXY-ALPHA-CYANOCINNAMATE | HY-138688 | SCHEMBL9215428 | 2-Cyano-3-(3,4-dihydrox...
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3,6'-Disinapoyl sucroseCas Number: 139891-98-8 Compound CID: 11968389Formula: C34H42O19 Molecular Weight: 754.69IUPAC Name: show moreSMILES: COC1=CC(=CC(=C1O)OC)C=CC(=O)OCC2C(C(C(C(O2)OC3(C(C(C(O3)CO)O)OC(=O)C=CC4=CC(=C(C(=C4)OC)O)OC)CO)O)O)OInChIKey: FHIJMQWMMZEFBL-OPSYHMPNSA-NInChI: show moreSynonyms: (Z/E)-3 inverted exclamation marka,6-Disinapoylsucrose | AKOS030530164 | .ALPHA.-D-GLUCOPYRANOSIDE, 3-O-((2E)-3-(4-HY...
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3,6'-Disinapoyl sucroseCas Number: 139891-98-8 Compound CID: 11968389Formula: C34H42O19 Molecular Weight: 754.69IUPAC Name: show moreSMILES: COC1=CC(=CC(=C1O)OC)C=CC(=O)OCC2C(C(C(C(O2)OC3(C(C(C(O3)CO)O)OC(=O)C=CC4=CC(=C(C(=C4)OC)O)OC)CO)O)O)OInChIKey: FHIJMQWMMZEFBL-OPSYHMPNSA-NInChI: show moreSynonyms: 3',6-Disinapoylsucrose|139891-98-8|(3-Sinapoyl)fructofuranosyl-(6-sinapoyl)glucopyranoside|Disinapoyl sucrose|3,6'-Di...
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3,4-Dimethoxycinnamic acidCas Number: 2316-26-9 EC Number: 219-025-5Formula: C11H12O4 Molecular Weight: 208.21IUPAC Name: (E)-3-(3,4-dimethoxyphenyl)prop-2-enoic acidSMILES: COC1=C(C=C(C=C1)C=CC(=O)O)OCInChIKey: HJBWJAPEBGSQPR-GQCTYLIASA-NInChI: InChI=1S/C11H12O4/c1-14-9-5-3-8(4-6-11(12)13)7-10(9)15-2/h3-7H,1-2H3,(H,12,13)/b6-4+Synonyms: 3,4-DIMETHOXYCINNAMIC ACID|2316-26-9|14737-89-4|Dimethylcaffeic acid|(E)-3-(3,4-dimethoxyphenyl)acrylic acid|(E)-3,4-...
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3,4,5-Trimethoxycinnamic acidCas Number: 90-50-6 EC Number: 201-999-8Formula: C12H14O5 Molecular Weight: 238.24IUPAC Name: (E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoic acidSMILES: COC1=CC(=CC(=C1OC)OC)C=CC(=O)OInChIKey: YTFVRYKNXDADBI-SNAWJCMRSA-NInChI: InChI=1S/C12H14O5/c1-15-9-6-8(4-5-11(13)14)7-10(16-2)12(9)17-3/h4-7H,1-3H3,(H,13,14)/b5-4+Synonyms: 3,4,5-TRIMETHOXYCINNAMIC ACID|90-50-6|20329-98-0|O-Methylsinapic acid|3-(3,4,5-trimethoxyphenyl)acrylic acid|SINAPIC ...
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2-Methoxycinnamic acidCas Number: 6099-03-2 EC Number: 228-047-4Formula: C10H10O3 Molecular Weight: 178.18IUPAC Name: (E)-3-(2-methoxyphenyl)prop-2-enoic acidSMILES: COC1=CC=CC=C1C=CC(=O)OInChIKey: FEGVSPGUHMGGBO-VOTSOKGWSA-NInChI: InChI=1S/C10H10O3/c1-13-9-5-3-2-4-8(9)6-7-10(11)12/h2-7H,1H3,(H,11,12)/b7-6+Synonyms: 2-Methoxycinnamic acid|1011-54-7|6099-03-2|trans-2-Methoxycinnamic acid|3-(2-Methoxyphenyl)acrylic acid|o-Methoxycinn...
