(Q27896020)

hexadecyl butanoate (English)

20 November 2016

canonical SMILES

CCCCCCCCCCCCCCCCOC(=O)CCC

1 reference

hexadecyl butanoate (English)

InChI=1S/C20H40O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-19-22-20(21)18-4-2/h3-19H2,1-2H3

20 November 2016

Identifiers

InChI

1 reference

hexadecyl butanoate (English)

20 November 2016

1 reference

Global Substance Registration System

hexadecyl butanoate (English)

20 November 2016

1 reference

UNII

K61DJ5AI3N

cetyl butyrate (English)

20 November 2016

1 reference

Hexadecyl butyrate (English)

20 November 2016

2 references

hexadecyl butanoate (English)

20 November 2016

ChEBI ID

179719

mapping relation type

exact match

2 references

stated in

ChEBI release 2022-06-13

International Chemical Identifier

InChI

InChI=1S/C20H40O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-19-22-20(21)18-4-2/h3-19H2,1-2H3

SureChEMBL ID

SCHEMBL334051

2 references

based on heuristic

inferred from InChIKey

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

1 reference

2 references

DSSTOX compound identifier

0 references

2 references

Global Substance Registration System

UNII

K61DJ5AI3N

cetyl butyrate (English)

20 November 2016

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

1 reference