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| Compound number: |
MolPort-001-740-212
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| CAS number: | 327-97-9 |
| IUPAC: |
(1S,3R,4R,5R)-3-{[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-1,4,5-trihydroxycyclohexane-1-carboxylic acid
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| IUPAC traditional: |
chlorogenic acid
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| SMILES: |
O[C@@H]1C[C@](O)(C[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@@H]1O)C(O)=O |r|
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| InChI key: |
CWVRJTMFETXNAD-JUHZACGLSA-N
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| Molecular formula: |
C16H18O9
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| Molecular weight: | 354.311 |
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| Compound number: | MolPort-001-740-212 |
| CAS number: | 327-97-9 |
| Name: | ZINC000002138728 |
| MFCD00003862 | |
| "1,3,4,5-Tetrahydroxycyclohexanecarboxylic acid" | |
| 1,3,4,5-Tetrahydroxy-cyclohexanecarboxylic acid 3-(3,4-dihydroxycinnamate) | |
| 1,3,4,5-Tetrahydroxy-cyclohexanecarboxylic acid 3-[3,4-dihydroxycinnamate] | |
| (1S,3R,4R,5R)-3-{[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-1,4,5-trihydroxycyclohexanecarboxylic acid | |
| (1S,3R,4R,5R)-3-(((E)-3-(3,4-dihydroxyphenyl)acryloyl)oxy)-1,4,5-trihydroxycyclohexanecarboxylic acid | |
| (1S,3R,4R,5R)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,4,5-trihydroxy-cyclohexanecarboxylic acid | |
| 3-[[3-(3,4-dihydroxyphenyl)-1-oxy-2-propenyl]oxy]-1,4,5-trihydroxy-1, [1S-(1 a , 3 ß , 4 a , 5 a )] | |
| 3-(3,4-Dihydroxycinnamoyl)quinic acid | |
| 3-O-Caffeoylquinic acidHeriguardNSC-407296 | |
| 3R-[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1S,4R,5R-trihydroxy-cyclohexanecarboxylic acid | |
| (3R)-[[3-(3,4-Dihydroxyphenyl)-1-oxo-2-propenyl]oxyl]-1S,4R,5R-trihydroxy-cyclohexanecarboxylic acid | |
| CHLOROGENIC ACID | |
| Chlorogenic acid | |
| Chlorogenic acid, Chiral | |
| Chlorogenic acid hemihydrate | |
| CHLOROGENICACID | |
| Cyclohexanecarboxylic acid,3-[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1,4,5-trihydroxy-,(1S,3R,4R,5R)- | |
| NSC 407296Heriguard |
| InChI: | 1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16+/m1/s1 |
| InChI key: | CWVRJTMFETXNAD-JUHZACGLSA-N |
| Molecular formula: | C16H18O9 |
| Molecular weight: | 354.311 |
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