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Hydroxycinnamic acids and derivatives
Description:
Compounds containing an cinnamic acid (or a derivative thereof) where the benzene ring is hydroxylated.
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Caffeic acidCas Number: 331-39-5 EC Number: 206-361-2Formula: C9H8O4 Molecular Weight: 180.16IUPAC Name: (E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acidSMILES: C1=CC(=C(C=C1C=CC(=O)O)O)OInChIKey: QAIPRVGONGVQAS-DUXPYHPUSA-NInChI: InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+Synonyms: (E)-3,4-dihydroxycinnamic acid | 3,4-Dihydroxycinnamic acid
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Caffeic acidCas Number: 331-39-5 EC Number: 206-361-2Formula: C9H8O4 Molecular Weight: 180.16IUPAC Name: (E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acidSMILES: C1=CC(=C(C=C1C=CC(=O)O)O)OInChIKey: QAIPRVGONGVQAS-DUXPYHPUSA-NInChI: InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+Synonyms: (2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | caffeic acid | 3-(3,4-dihydroxyphenyl)acrylic acid | (E)-3,4-dihydrox...
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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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AG 99Cas Number: 122520-85-8Formula: C10H8N2O3 Molecular Weight: 204.18IUPAC Name: (E)-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamideSMILES: C1=CC(=C(C=C1C=C(C#N)C(=O)N)O)OInChIKey: USOXQZNJFMKTKJ-XVNBXDOJSA-NInChI: InChI=1S/C10H8N2O3/c11-5-7(10(12)15)3-6-1-2-8(13)9(14)4-6/h1-4,13-14H,(H2,12,15)/b7-3+Synonyms: Tyrphostin A46|AG 99|122520-85-8|Tyrphostin 46|118409-59-9|Tyrphostin AG 99|AG-99|(E)-2-cyano-3-(3,4-dihydroxyphenyl)...
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AG 555 (Tyrphostin B46)Cas Number: 133550-34-2Formula: C19H18N2O3 Molecular Weight: 322.36IUPAC Name: (E)-2-cyano-3-(3,4-dihydroxyphenyl)-N-(3-phenylpropyl)prop-2-enamideSMILES: C1=CC=C(C=C1)CCCNC(=O)C(=CC2=CC(=C(C=C2)O)O)C#NInChIKey: GSQOBTOAOGXIFL-LFIBNONCSA-NInChI: InChI=1S/C19H18N2O3/c20-13-16(11-15-8-9-17(22)18(23)12-15)19(24)21-10-4-7-14-5-2-1-3-6-14/h1-3,5-6,8-9,11-12,22-23H,4,7,10H2,(H,21,24)/b16-11+Synonyms: NCGC00016028-05 | Tyrphostin deriv. 46 | J-006402 | 2-Propenamide,2-cyano-3-(3,4-dihydroxyphenyl)-N-(3-phenylpropyl)-...
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4-Hydroxycinnamic acidCas Number: 7400-08-0Formula: C9H8O3 Molecular Weight: 164.16IUPAC Name: (E)-3-(4-hydroxyphenyl)prop-2-enoic acidSMILES: C1=CC(=CC=C1C=CC(=O)O)OInChIKey: NGSWKAQJJWESNS-ZZXKWVIFSA-NInChI: InChI=1S/C9H8O3/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-6,10H,(H,11,12)/b6-3+Synonyms: Dehydroepiandrosterone-[D6] (CertiMass solution) | Para-Coumaric acid | b-[4-Hydroxyphenyl]acrylate | Cinnamic acid, ...
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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...
