(Q27116111)

9,10,13-Trihydroxy-11-octadecenoic acid (English)

6 October 2016

chemical formula

C₁₈H₃₄O₅

1 reference

9,10,13-Trihydroxy-11-octadecenoic acid (English)

6 October 2016

canonical SMILES

CCCCCC(C=CC(C(CCCCCCCC(=O)O)O)O)O

1 reference

9,10,13-Trihydroxy-11-octadecenoic acid (English)

6 October 2016

isomeric SMILES

CCCCCC(/C=C/C(C(CCCCCCCC(=O)O)O)O)O

1 reference

The human serum metabolome

9,10,13-Trihydroxy-11-octadecenoic acid (English)

6 October 2016

1 reference

Identifiers

InChI

InChI=1S/C18H34O5/c1-2-3-7-10-15(19)13-14-17(21)16(20)11-8-5-4-6-9-12-18(22)23/h13-17,19-21H,2-12H2,1H3,(H,22,23)/b14-13+

1 reference

9,10,13-Trihydroxy-11-octadecenoic acid (English)

NTVFQBIHLSPEGQ-BUHFOSPRSA-N

6 October 2016

InChIKey

2 references

9,10,13-Trihydroxy-11-octadecenoic acid (English)

6 October 2016

stated in

ChEBI release 2020-09-01

2 references

9,10,13-TriHOME (English)

NTVFQBIHLSPEGQ-BUHFOSPRSA-N

6 October 2016

InChIKey

9 April 2021

https://commonchemistry.cas.org/detail?cas_rn=29907-57-1

1 reference

9,10,13-Trihydroxy-11-octadecenoic acid (English)

6 October 2016

1 reference

9,10,13-Trihydroxy-11-octadecenoic acid (English)

6 October 2016

Reaxys registry number

2282736

1 reference

9,10,13-TriHOME (English)

6 October 2016

ChEBI ID

34499

mapping relation type

1 reference

DSSTOX compound identifier

9,10,13-TriHOME (English)

6 October 2016

1 reference

inferred from InChIKey

SCHEMBL1134688

1 reference

based on heuristic

inferred from InChIKey

1 reference

0 references

0 references

1 reference

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

9,10,13-TriHOME (English)

6 October 2016

1 reference