(Q27158425)

15-deoxy-Delta(12,14)-prostaglandin J2 (English)

9 October 2016

chemical formula

C₂₀H₂₇O₃⁻

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CCCCCC=CC=C1C(C=CC1=O)CC=CCCCC(=O)[O-]

1 reference

15-deoxy-Delta(12,14)-prostaglandin J2 (English)

9 October 2016

isomeric SMILES

CCCCC/C=C/C=C/1\[C@H](C=CC1=O)C/C=C\CCCC(=O)[O-]

1 reference

15-deoxy-Delta(12,14)-prostaglandin J2 (English)

InChI=1S/C20H28O3/c1-2-3-4-5-6-10-13-18-17(15-16-19(18)21)12-9-7-8-11-14-20(22)23/h6-7,9-10,13,15-17H,2-5,8,11-12,14H2,1H3,(H,22,23)/p-1/b9-7-,10-6+,18-13+/t17-/m0/s1

9 October 2016

Identifiers

InChI

1 reference

15-deoxy-Delta(12,14)-prostaglandin J2 (English)

VHRUMKCAEVRUBK-GODQJPCRSA-M

9 October 2016

InChIKey

2 references

15-deoxy-Delta(12,14)-prostaglandin J2 (English)

9 October 2016

stated in

ChEBI release 2020-09-01

1 reference

(5Z,12E,14E)-11-Oxoprosta-5,9,12,14-tetraen-1-oate (English)

9 October 2016

1 reference

15-deoxy-Delta(12,14)-prostaglandin J2 (English)

9 October 2016

ChEBI ID

85236

mapping relation type

1 reference

https://www.swisslipids.org/#/downloads

15-deoxy-Delta(12,14)-prostaglandin J2(1-) (English)

9 October 2016

1 reference

1 reference