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3-hydroxy-3-methylglutaryl-CoA

chemical compound
ChemicalSubstance group_of_stereoisomers Q27108899
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3-hydroxy-3-methylglutaryl-CoA

Summary

3-hydroxy-3-methylglutaryl-CoA is a group of stereoisomers[1].

Key Facts

  • 3-hydroxy-3-methylglutaryl-CoA's instance of is recorded as group of stereoisomers[2].
  • 3-hydroxy-3-methylglutaryl-CoA's CAS Registry Number is recorded as 1553-55-5[3].
  • 3-hydroxy-3-methylglutaryl-CoA's canonical SMILES is recorded as CC(C)(COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C2N=CN=C3N)O)OP(=O)(O)O)C(C(=O)NCCC(=O)NCCSC(=O)CC(C)(CC(=O)O)O)O[4].
  • 3-hydroxy-3-methylglutaryl-CoA's InChI is recorded as InChI=1S/C27H44N7O20P3S/c1-26(2,21(40)24(41)30-5-4-15(35)29-6-7-58-17(38)9-27(3,42)8-16(36)37)11-51-57(48,49)54-56(46,47)50-10-14-20(53-55(43,44)45)19(39)25(52-14)34-13-33-18-22(28)31-12-32-23(18)34/h12-14,19-21,25,39-40,42H,4-11H2,1-3H3,(H,29,35)(H,30,41)(H,36,37)(H,46,47)(H,48,49)(H2,28,31,32)(H2,43,44,45)/t14-,19-,20-,21+,25-,27?/m1/s1[5].
  • 3-hydroxy-3-methylglutaryl-CoA's InChIKey is recorded as CABVTRNMFUVUDM-SJBCKIPMSA-N[6].
  • 3-hydroxy-3-methylglutaryl-CoA's chemical formula is recorded as C₂₇H₄₄N₇O₂₀P₃S[7].
  • 3-hydroxy-3-methylglutaryl-CoA's subclass of is recorded as fatty acyl-CoA[8].
  • 3-hydroxy-3-methylglutaryl-CoA's ChemSpider ID is recorded as 82627[9].
  • 3-hydroxy-3-methylglutaryl-CoA's PubChem CID is recorded as 91506[10].
  • 3-hydroxy-3-methylglutaryl-CoA's ChEBI ID is recorded as 11814[11].
  • 3-hydroxy-3-methylglutaryl-CoA's isomeric SMILES is recorded as CC(C)(COP(=O)(O)OP(=O)(O)OC[C@@H]1C@HOP(=O)(O)O)C@HOC@HOP(=O)(O)O)C@HO">[12].
  • 3-hydroxy-3-methylglutaryl-CoA's LIPID MAPS ID is recorded as LMFA07050209[13].
  • 3-hydroxy-3-methylglutaryl-CoA's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+911.157468'}[14].
  • 3-hydroxy-3-methylglutaryl-CoA's SureChEMBL ID is recorded as 219453[15].
  • 3-hydroxy-3-methylglutaryl-CoA's DSSTox substance ID is recorded as DTXSID00935181[16].
  • 3-hydroxy-3-methylglutaryl-CoA's UniChem compound ID is recorded as 1096934[17].

References

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

Direct Wikidata claims

  1. [2] ↑ . wikidata.org.
  2. [3] ↑ . Chemical Abstracts Service. Retrieved . wikidata.org.
  3. [4] ↑ . PubChem. Retrieved . wikidata.org.
  4. [5] ↑ . PubChem. Retrieved . wikidata.org.
  5. [6] ↑ . PubChem. Retrieved . wikidata.org.
  6. [7] ↑ . PubChem. Retrieved . wikidata.org.
  7. [8] ↑ . wikidata.org.
  8. [9] ↑ . Q2311683. Retrieved . wikidata.org.
  9. [10] ↑ . PubChem. Retrieved . wikidata.org.
  10. [11] ↑ . ChEBI. Retrieved . wikidata.org.
  11. [12] ↑ . PubChem. Retrieved . wikidata.org.
  12. [13] ↑ . LIPID MAPS. Retrieved . lipidmaps.org. Provenance: wikidata.org.
  13. [14] ↑ . PubChem. Retrieved . wikidata.org.
  14. [15] ↑ . wikidata.org.
  15. [16] ↑ . wikidata.org.
  16. [17] ↑ . UniChem. wikidata.org.

Class ancestry

  1. [1] ↑ . Wikidata. wikidata.org.

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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). 3-hydroxy-3-methylglutaryl-CoA. Retrieved May 3, 2026, from https://4ort.xyz/entity/3-hydroxy-3-methylglutaryl-coa
MLA “3-hydroxy-3-methylglutaryl-CoA.” 4ort.xyz Knowledge Graph, 4ort.xyz, 3 May. 2026, https://4ort.xyz/entity/3-hydroxy-3-methylglutaryl-coa.
BibTeX @misc{4ortxyz_3-hydroxy-3-methylglutaryl-coa_2026, author = {{4ort.xyz Knowledge Graph}}, title = {{3-hydroxy-3-methylglutaryl-CoA}}, year = {2026}, url = {https://4ort.xyz/entity/3-hydroxy-3-methylglutaryl-coa}, note = {Accessed: 2026-05-03}}
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