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CH3-malonyl-CoA

group of stereoisomers with the chemical formula C₂₅H₄₀N₇O₁₉P₃S
ChemicalSubstance group_of_stereoisomers Q82096586
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CH3-malonyl-CoA

Summary

CH3-malonyl-CoA is a group of stereoisomers[1].

Key Facts

  • CH3-malonyl-CoA's instance of is recorded as group of stereoisomers[2].
  • CH3-malonyl-CoA's CAS Registry Number is recorded as 73173-91-8[3].
  • CH3-malonyl-CoA's canonical SMILES is recorded as CC(C(=O)O)C(=O)SCCN=C(O)CCN=C(O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O[4].
  • CH3-malonyl-CoA's InChI is recorded as InChI=1S/C25H40N7O19P3S/c1-12(23(37)38)24(39)55-7-6-27-14(33)4-5-28-21(36)18(35)25(2,3)9-48-54(45,46)51-53(43,44)47-8-13-17(50-52(40,41)42)16(34)22(49-13)32-11-31-15-19(26)29-10-30-20(15)32/h10-13,16-18,22,34-35H,4-9H2,1-3H3,(H,27,33)(H,28,36)(H,37,38)(H,43,44)(H,45,46)(H2,26,29,30)(H2,40,41,42)/t12-,13+,16+,17+,18?,22+/m0/s1[5].
  • CH3-malonyl-CoA's InChIKey is recorded as MZFOKIKEPGUZEN-PNEPRAIJSA-N[6].
  • CH3-malonyl-CoA's chemical formula is recorded as C₂₅H₄₀N₇O₁₉P₃S[7].
  • CH3-malonyl-CoA's subclass of is recorded as 9-{5-O-[{[(4-{[3-({2-[(2-Carboxypropanoyl)sulfanyl]ethyl}imino)-3-hydroxypropyl]imino}-3,4-dihydroxy-2,2-dimethylbutoxy)(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]-3-O-phosphonopentofuranosyl}-9H-purin-6-amine[8].
  • CH3-malonyl-CoA's PubChem CID is recorded as 439291[9].
  • CH3-malonyl-CoA's isomeric SMILES is recorded as CC@@HC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1OC@@HC@H[C@@H]1OP(=O)(O)OC@@HC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1OC@@HC@H[C@@H]1OP(=O)(O)O">[10].
  • CH3-malonyl-CoA's Human Metabolome Database ID is recorded as HMDB0001269[11].
  • CH3-malonyl-CoA's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+867.1312529499999'}[12].
  • CH3-malonyl-CoA's SureChEMBL ID is recorded as 29378271[13].
  • CH3-malonyl-CoA's DSSTox substance ID is recorded as DTXSID00331402[14].
  • CH3-malonyl-CoA's DSSTOX compound identifier is recorded as DTXCID10282496[15].
  • CH3-malonyl-CoA's UniChem compound ID is recorded as 1073941[16].

References

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

Direct Wikidata claims

  1. [2] ↑ . wikidata.org.
  2. [3] ↑ . wikidata.org.
  3. [4] ↑ . wikidata.org.
  4. [5] ↑ . wikidata.org.
  5. [6] ↑ . wikidata.org.
  6. [7] ↑ . wikidata.org.
  7. [8] ↑ . wikidata.org.
  8. [9] ↑ . PubChem. Retrieved . wikidata.org.
  9. [10] ↑ . wikidata.org.
  10. [11] ↑ . wikidata.org.
  11. [12] ↑ . wikidata.org.
  12. [13] ↑ . wikidata.org.
  13. [14] ↑ . wikidata.org.
  14. [15] ↑ . wikidata.org.
  15. [16] ↑ . UniChem. wikidata.org.

Class ancestry

  1. [1] ↑ . Wikidata. wikidata.org.

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APA 4ort.xyz Knowledge Graph. (2026). CH3-malonyl-CoA. Retrieved May 3, 2026, from https://4ort.xyz/entity/ch3-malonyl-coa
MLA “CH3-malonyl-CoA.” 4ort.xyz Knowledge Graph, 4ort.xyz, 3 May. 2026, https://4ort.xyz/entity/ch3-malonyl-coa.
BibTeX @misc{4ortxyz_ch3-malonyl-coa_2026, author = {{4ort.xyz Knowledge Graph}}, title = {{CH3-malonyl-CoA}}, year = {2026}, url = {https://4ort.xyz/entity/ch3-malonyl-coa}, note = {Accessed: 2026-05-03}}
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