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Cinnamic acids and derivatives
Description:
Organic aromatic compounds containing a benzene and a carboxylic acid group (or a derivative thereof) forming 3-phenylprop-2-enoic acid.
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Tranilast SodiumCas Number: 104931-56-8 Compound CID: 23669590Formula: C18H16NNaO5 Molecular Weight: 349.3IUPAC Name: sodium;2-[[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]amino]benzoateSMILES: COC1=C(C=C(C=C1)C=CC(=O)NC2=CC=CC=C2C(=O)[O-])OC.[Na+]InChIKey: KZGHWWBBHZLTTA-VRTOBVRTSA-MInChI: InChI=1S/C18H17NO5.Na/c1-23-15-9-7-12(11-16(15)24-2)8-10-17(20)19-14-6-4-3-5-13(14)18(21)22;/h3-11H,1-2H3,(H,19,20)(H,21,22);/q;+1/p-1/b10-8+;
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(E)-3-(3,4,5-Trihydroxyphenyl)acrylic acidIUPAC Name: (E)-3-(3,4,5-trihydroxyphenyl)prop-2-enoic acidSMILES: C1=C(C=C(C(=C1O)O)O)C=CC(=O)OInChIKey: ACEAELOMUCBPJP-OWOJBTEDSA-NInChI: InChI=1S/C9H8O5/c10-6-3-5(1-2-8(12)13)4-7(11)9(6)14/h1-4,10-11,14H,(H,12,13)/b2-1+
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(E)-methyl 3-(o-tolyl)acrylateCas Number: 130451-86-4 Compound CID: 10176349Formula: C11H12O2 Molecular Weight: 176.21IUPAC Name: methyl (E)-3-(2-methylphenyl)prop-2-enoateSMILES: CC1=CC=CC=C1C=CC(=O)OCInChIKey: FVSMIMXZNUZTOE-BQYQJAHWSA-NInChI: InChI=1S/C11H12O2/c1-9-5-3-4-6-10(9)7-8-11(12)13-2/h3-8H,1-2H3/b8-7+
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ethyl 3-(2-fluorophenyl)acrylateCas Number: 348-13-0 Compound CID: 5373049IUPAC Name: ethyl (E)-3-(2-fluorophenyl)prop-2-enoateSMILES: CCOC(=O)C=CC1=CC=CC=C1FInChIKey: YOIVHDQJCFLRRB-BQYQJAHWSA-NInChI: InChI=1S/C11H11FO2/c1-2-14-11(13)8-7-9-5-3-4-6-10(9)12/h3-8H,2H2,1H3/b8-7+
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ethyl (E)-3-(4-isopropylphenyl)acrylateCas Number: 128408-02-6Formula: C14H18O2 Molecular Weight: 218.3
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Sibiricose A1Cas Number: 139726-40-2 Compound CID: 6326016IUPAC Name: show moreSMILES: COC1=CC(=CC(=C1O)OC)C=CC(=O)OCC2C(C(C(C(O2)OC3(C(C(C(O3)CO)O)O)CO)O)O)OInChIKey: DJBWDHVUJCXYBH-IBVGEFGBSA-NInChI: show more
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N1,N5,N10-Tri-p-coumaroylspermidineCas Number: 131086-78-7Formula: C34H37N3O6 Molecular Weight: 583.67SMILES: C1=CC(=CC=C1C=CC(=O)NCCCCN(CCCNC(=O)C=CC2=CC=C(C=C2)O)C(=O)C=CC3=CC=C(C=C3)O)OInChIKey: PFDVWJCSCYDRMZ-AUCPOXKISA-NInChI: show more
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Methyl 2-(2-nitrobenzylidene)acetoacetateCas Number: 39562-27-1 Compound CID: 2259865Formula: C12H11NO5 Molecular Weight: 249.22IUPAC Name: methyl (2E)-2-[(2-nitrophenyl)methylidene]-3-oxobutanoateSMILES: CC(=O)C(=CC1=CC=CC=C1[N+](=O)[O-])C(=O)OCInChIKey: APKKCRAKPMSAEI-JXMROGBWSA-NInChI: InChI=1S/C12H11NO5/c1-8(14)10(12(15)18-2)7-9-5-3-4-6-11(9)13(16)17/h3-7H,1-2H3/b10-7+
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Ethyl 2-(3-nitrobenzylidene)acetoacetateCas Number: 39562-16-8 EC Number: 404-490-0, 609-718-4 Compound CID: 768581IUPAC Name: ethyl (2E)-2-[(3-nitrophenyl)methylidene]-3-oxobutanoateSMILES: CCOC(=O)C(=CC1=CC(=CC=C1)[N+](=O)[O-])C(=O)CInChIKey: YOPMSDPIOQUWFE-XYOKQWHBSA-NInChI: InChI=1S/C13H13NO5/c1-3-19-13(16)12(9(2)15)8-10-5-4-6-11(7-10)14(17)18/h4-8H,3H2,1-2H3/b12-8+
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Ethyl 3-(4-hydroxyphenyl)acrylateCas Number: 2979-06-8 Compound CID: 676946Formula: C11H12O3 Molecular Weight: 192.21IUPAC Name: ethyl (E)-3-(4-hydroxyphenyl)prop-2-enoateSMILES: CCOC(=O)C=CC1=CC=C(C=C1)OInChIKey: ZOQCEVXVQCPESC-VMPITWQZSA-NInChI: InChI=1S/C11H12O3/c1-2-14-11(13)8-5-9-3-6-10(12)7-4-9/h3-8,12H,2H2,1H3/b8-5+
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Benzyl ferulateCas Number: 132335-97-8 Compound CID: 7766335IUPAC Name: benzyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoateSMILES: COC1=C(C=CC(=C1)C=CC(=O)OCC2=CC=CC=C2)OInChIKey: DZAPHTCUSDTZAT-CSKARUKUSA-NInChI: InChI=1S/C17H16O4/c1-20-16-11-13(7-9-15(16)18)8-10-17(19)21-12-14-5-3-2-4-6-14/h2-11,18H,12H2,1H3/b10-8+
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(s)-(+)-2-methylbutyl p-[(p-methoxybenzylidene)amino]cinnamateCas Number: 24140-30-5Formula: C22H25NO3 Molecular Weight: 351.446SMILES: CCC(C)COC(=O)C=CC1=CC=C(C=C1)N=CC2=CC=C(C=C2)OCInChIKey: FKZXVOQEYXOXAD-VPCHJHAQSA-NInChI: InChI=1S/C22H25NO3/c1-4-17(2)16-26-22(24)14-9-18-5-10-20(11-6-18)23-15-19-7-12-21(25-3)13-8-19/h5-15,17H,4,16H2,1-3H3/b14-9+,23-15?/t17-/m0/s1
