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4-coumaroyl-CoA

chemical compound
ChemicalSubstance group_of_stereoisomers Q57828471
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4-coumaroyl-CoA

Summary

4-coumaroyl-CoA is a group of stereoisomers[1].

Key Facts

  • 4-coumaroyl-CoA's instance of is recorded as group of stereoisomers[2].
  • 4-coumaroyl-CoA's CAS Registry Number is recorded as 30802-00-7[3].
  • 4-coumaroyl-CoA's canonical SMILES is recorded as O=C(SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(N2C=NC=3C(=NC=NC32)N)C(O)C1OP(=O)(O)O)C=CC4=CC=C(O)C=C4[4].
  • 4-coumaroyl-CoA's InChI is recorded as InChI=1S/C30H42N7O18P3S/c1-30(2,25(42)28(43)33-10-9-20(39)32-11-12-59-21(40)8-5-17-3-6-18(38)7-4-17)14-52-58(49,50)55-57(47,48)51-13-19-24(54-56(44,45)46)23(41)29(53-19)37-16-36-22-26(31)34-15-35-27(22)37/h3-8,15-16,19,23-25,29,38,41-42H,9-14H2,1-2H3,(H,32,39)(H,33,43)(H,47,48)(H,49,50)(H2,31,34,35)(H2,44,45,46)/t19-,23-,24-,25+,29-/m1/s1[5].
  • 4-coumaroyl-CoA's InChIKey is recorded as DMZOKBALNZWDKI-FUEUKBNZSA-N[6].
  • 4-coumaroyl-CoA's chemical formula is recorded as C₃₀H₄₂N₇O₁₈P₃S[7].
  • 4-coumaroyl-CoA's subclass of is recorded as fatty acyl-CoA[8].
  • 4-coumaroyl-CoA's PubChem CID is recorded as 147899[9].
  • 4-coumaroyl-CoA's ChEBI ID is recorded as 15499[10].
  • 4-coumaroyl-CoA's found in taxon is recorded as Homo sapiens[11].
  • 4-coumaroyl-CoA's isomeric SMILES is recorded as CC(C)(COP(O)(=O)OP(O)(=O)OC[C@H]1OC@Hn1cnc2c(N)ncnc12)C@@HC(=O)NCCC(=O)NCCSC(=O)C=Cc1ccc(O)cc1C@Hn1cnc2c(N)ncnc12)C@@HC(=O)NCCC(=O)NCCSC(=O)C=Cc1ccc(O)cc1">[12].
  • 4-coumaroyl-CoA's Human Metabolome Database ID is recorded as HMDB0304822[13].
  • 4-coumaroyl-CoA's LIPID MAPS ID is recorded as LMFA07050265[14].
  • 4-coumaroyl-CoA's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+913.151988394'}[15].
  • 4-coumaroyl-CoA's SureChEMBL ID is recorded as 320157[16].
  • 4-coumaroyl-CoA's UniChem compound ID is recorded as 1105021[17].
  • 4-coumaroyl-CoA's Cannabis Database ID is recorded as 005179[18].

References

Programmatic citations — every numbered marker resolves to a verifiable graph row below.

Direct Wikidata claims

  1. [2] ↑ . wikidata.org.
  2. [3] ↑ . SciFinder. wikidata.org.
  3. [4] ↑ . wikidata.org.
  4. [5] ↑ . wikidata.org.
  5. [6] ↑ . ChEBI release 2020-09-01. wikidata.org.
  6. [7] ↑ . wikidata.org.
  7. [8] ↑ . wikidata.org.
  8. [9] ↑ . wikidata.org.
  9. [10] ↑ . wikidata.org.
  10. [11] ↑ . Recon 2.2: from reconstruction to model of human metabolism. wikidata.org.
  11. [12] ↑ . wikidata.org.
  12. [13] ↑ . wikidata.org.
  13. [14] ↑ . LIPID MAPS. Retrieved . lipidmaps.org. Provenance: wikidata.org.
  14. [15] ↑ . wikidata.org.
  15. [16] ↑ . wikidata.org.
  16. [17] ↑ . UniChem. wikidata.org.
  17. [18] ↑ . Cannabis Database. wikidata.org.

Class ancestry

  1. [1] ↑ . Wikidata. wikidata.org.

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APA 4ort.xyz Knowledge Graph. (2026). 4-coumaroyl-CoA. Retrieved May 3, 2026, from https://4ort.xyz/entity/4-coumaroyl-coa
MLA “4-coumaroyl-CoA.” 4ort.xyz Knowledge Graph, 4ort.xyz, 3 May. 2026, https://4ort.xyz/entity/4-coumaroyl-coa.
BibTeX @misc{4ortxyz_4-coumaroyl-coa_2026, author = {{4ort.xyz Knowledge Graph}}, title = {{4-coumaroyl-CoA}}, year = {2026}, url = {https://4ort.xyz/entity/4-coumaroyl-coa}, note = {Accessed: 2026-05-03}}
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