trans-dodec-2-enoyl-CoA

chemical compound

ChemicalSubstance group_of_stereoisomers Q27089455

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trans-dodec-2-enoyl-CoA

Summary

trans-dodec-2-enoyl-CoA is a group of stereoisomers^[1].

Key Facts

trans-dodec-2-enoyl-CoA's instance of is recorded as group of stereoisomers^[2].
trans-dodec-2-enoyl-CoA's canonical SMILES is recorded as CCCCCCCCCC=CC(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C2N=CN=C3N)O)OP(=O)(O)O)O^[3].
trans-dodec-2-enoyl-CoA's chemical formula is recorded as C₃₃H₅₆N₇O₁₇P₃S^[4].
trans-dodec-2-enoyl-CoA is a type of fatty acyl-CoA^[5].
trans-dodec-2-enoyl-CoA's found in taxon is recorded as Homo sapiens^[6].
trans-dodec-2-enoyl-CoA's isomeric SMILES is recorded as CCCCCCCCC/C=C/C(=O)SCCNC(=O)CCNC(=O)C@@HO^C@@HO">[7].
trans-dodec-2-enoyl-CoA's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+947.266624'}^[8].

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Quick Facts

Instance of group of stereoisomers

Subclass of fatty acyl-CoA

Properties

Canonical smiles CCCCCCCCCC=CC(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C2N=CN=C3N)O)OP(=O)(O)O)O

Chemical formula C₃₃H₅₆N₇O₁₇P₃S

Found in taxon Homo sapiens

Isomeric smiles CCCCCCCCC/C=C/C(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C2N=CN=C3N)O)OP(=O)(O)O)O

Mass +947.266624

External References (12)

Cas registry number 1066-12-2

Chebi id 15471

Chemspider id 10140104

Human metabolome database id HMDB0304089

Inchi InChI=1S/C33H56N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-24(42)61-17-16-35-23(41)14-15-36-31(45)28(44)33(2,3)19-54-60(51,52)57-59(49,50)53-18-22-27(56-58(46,47)48)26(43)32(55-22)40-21-39-25-29(34)37-20-38-30(25)40/h12-13,20-22,26-28,32,43-44H,4-11,14-19H2,1-3H3,(H,35,41)(H,36,45)(H,49,50)(H,51,52)(H2,34,37,38)(H2,46,47,48)/b13-12+/t22-,26-,27-,28+,32-/m1/s1

Inchikey IRFYVBULXZMEDE-DEEZISNZSA-N

Kegg id C03221

Lipid maps id LMFA07050176

Pdb ligand id 8Z2

Pubchem cid 11966110

Surechembl id 1331291

Unichem compound id 1103883

🏷️ Also known as

en trans-dodec-2-enoyl-CoA

References

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

Direct Wikidata claims

[2] ↑ trans-dodec-2-enoyl-CoA — instance of (P31): group of stereoisomers. wikidata.org.
[3] ↑ trans-dodec-2-enoyl-CoA — canonical SMILES (P233): CCCCCCCCCC=CC(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C2N=CN=C3N)O)OP(=O)(O)O)O. PubChem. Retrieved 2016-10-04. wikidata.org.
[4] ↑ trans-dodec-2-enoyl-CoA — chemical formula (P274): C₃₃H₅₆N₇O₁₇P₃S. PubChem. Retrieved 2016-10-04. wikidata.org.
[5] ↑ trans-dodec-2-enoyl-CoA — subclass of (P279): fatty acyl-CoA. wikidata.org.
[6] ↑ trans-dodec-2-enoyl-CoA — found in taxon (P703): Homo sapiens. Recon 2.2: from reconstruction to model of human metabolism. wikidata.org.
[7] ↑ trans-dodec-2-enoyl-CoA — isomeric SMILES (P2017): CCCCCCCCC/C=C/C(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C2N=CN=C3N)O)OP(=O)(O)O)O. PubChem. Retrieved 2016-10-04. wikidata.org.
[8] ↑ trans-dodec-2-enoyl-CoA — mass (P2067): {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+947.266624'}. PubChem. Retrieved 2016-10-04. wikidata.org.

Class ancestry

[1] ↑ trans-dodec-2-enoyl-CoA is an instance of group of stereoisomers (Q59199015) [P31, primary]. Wikidata. wikidata.org.

📑 Cite this page

Use these citations when quoting this entity in research, articles, AI prompts, or wherever provenance matters. We aggregate Wikidata + Wikipedia + authoritative open-data sources; the stitched, scored, cross-referenced view is what 4ort.xyz contributes.

APA

4ort.xyz Knowledge Graph. (2026). trans-dodec-2-enoyl-CoA. Retrieved May 3, 2026, from https://4ort.xyz/entity/trans-dodec-2-enoyl-coa

MLA

“trans-dodec-2-enoyl-CoA.” 4ort.xyz Knowledge Graph, 4ort.xyz, 3 May. 2026, https://4ort.xyz/entity/trans-dodec-2-enoyl-coa.

BibTeX

@misc{4ortxyz_trans-dodec-2-enoyl-coa_2026, author = {{4ort.xyz Knowledge Graph}}, title = {{trans-dodec-2-enoyl-CoA}}, year = {2026}, url = {https://4ort.xyz/entity/trans-dodec-2-enoyl-coa}, note = {Accessed: 2026-05-03}}

LLM prompt

According to 4ort.xyz Knowledge Graph (aggregator of Wikidata, Wikipedia, and authoritative open-data sources): trans-dodec-2-enoyl-CoA — https://4ort.xyz/entity/trans-dodec-2-enoyl-coa (retrieved 2026-05-03)

Canonical URL: https://4ort.xyz/entity/trans-dodec-2-enoyl-coa · Last refreshed: May 3, 2026

Edit History

Rolling log of changes to this entity's Wikidata record. Values shown reflect the current state of each edited property — follow the history link to see the precise diff for any edit.

15w ago · Nabbegat · 2026-06-19 view diff on Wikidata ↗

Imported from → —

Kegg id → C03221

Instance of → group of stereoisomers

Unichem compound id → 1103883

+ 17 other properties edited (see Wikidata diff for full list)

"/* wbeditentity-update-languages-short:0||tr */ QuickStatements 3.0 [[:toollabs:qs-dev/batch/37300|batch #37300]]"

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