stearyl coenzyme a (Q15427851)

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chemical compound

C18:0-CoA
C18:0-coenzyme A
S-stearoyl-CoA
S-stearoylcoenzyme A
octadecanoyl-coenzyme A
octadecanoyl-CoA
stearoyl-coenzyme A

Language	Label	Description	Also known as
English	stearyl coenzyme a	chemical compound	C18:0-CoA C18:0-coenzyme A S-stearoyl-CoA S-stearoylcoenzyme A octadecanoyl-coenzyme A octadecanoyl-CoA stearoyl-coenzyme A

Statements

group of stereoisomers

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chemical structure

Stearoyl-CoA.png
4,968 × 1,296; 56 KB

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1,033.376±0 dalton

1 reference

language of work or name

Stearoyl-coenzyme A (English)

19 October 2016

chemical formula

C₃₉H₇₀N₇O₁₇P₃S

1 reference

language of work or name

Stearoyl-coenzyme A (English)

20 November 2016

canonical SMILES

CCCCCCCCCCCCCCCCCC(=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

1 reference

language of work or name

Stearoyl-coenzyme A (English)

20 November 2016

isomeric SMILES

CCCCCCCCCCCCCCCCCC(=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

1 reference

language of work or name

Stearoyl-coenzyme A (English)

20 November 2016

2 references

Recon 2.2: from reconstruction to model of human metabolism

A community-driven global reconstruction of human metabolism.

Identifiers

InChI=1S/C39H70N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-30(48)67-23-22-41-29(47)20-21-42-37(51)34(50)39(2,3)25-60-66(57,58)63-65(55,56)59-24-28-33(62-64(52,53)54)32(49)38(61-28)46-27-45-31-35(40)43-26-44-36(31)46/h26-28,32-34,38,49-50H,4-25H2,1-3H3,(H,41,47)(H,42,51)(H,55,56)(H,57,58)(H2,40,43,44)(H2,52,53,54)/t28-,32-,33-,34+,38-/m1/s1

1 reference

language of work or name

Stearoyl-coenzyme A (English)

20 November 2016

SIARJEKBADXQJG-LFZQUHGESA-N

2 references

language of work or name

Stearoyl-coenzyme A (English)

20 November 2016

ChEBI release 2020-09-01

CAS Registry Number

2 references

Global Substance Registration System

language of work or name

stearyl coenzyme a (English)

20 November 2016

SIARJEKBADXQJG-LFZQUHGESA-N

CAS Common Chemistry

10 April 2021

https://commonchemistry.cas.org/detail?cas_rn=362-66-3

1 reference

language of work or name

S-{(9R)-1-[(2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydro-2-furanyl]-3,5,9-trihydroxy-8,8-dimethyl-3,5-dioxido-10,14-dioxo-2,4,6-trioxa-11,15-diaza-3lambda~5~,5lambda~5~- (English)

20 November 2016

1 reference

language of work or name

Stearoyl-coenzyme A (English)

20 November 2016

Reaxys registry number

8033851

1 reference

language of work or name

stearoyl-CoA (English)

19 October 2016

mapping relation type

1 reference

language of work or name

stearoyl-CoA (English)

19 October 2016

UniChem compound ID

1 reference

206-648-2

1 reference

Global Substance Registration System

language of work or name

stearyl coenzyme a (English)

20 November 2016

ECHA Substance Infocard ID

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

27 December 2018

S-stearoylcoenzyme A (English)

CAS no.: 362-66-3 (English)

Cannabis Database ID

1 reference

Cannabis Database

Human Metabolome Database ID

1 reference

based on heuristic

inferred from InChIKey

1 reference

Global Substance Registration System

language of work or name

stearyl coenzyme a (English)

20 November 2016

0 references

1 reference

http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download

30 June 2018

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Microsoft Academic ID

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PDB structure ID

1 reference

Protein Data Bank

PDB structure ID

language of work or name

4ZYO (English)

19 October 2016

1 reference

Protein Data Bank

PDB structure ID

language of work or name

2WH5 (English)

19 October 2016

1 reference

Protein Data Bank

PDB structure ID

language of work or name

4YMK (English)

19 October 2016

1 reference

Protein Data Bank

PDB structure ID

language of work or name

3WHC (English)

19 October 2016

Sitelinks

Wikipedia(5 entries)

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Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(0 entries)

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