(Q100870368)

English

hepoxilin A3

pair of isomers

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Statements

group of stereoisomers

0 references

primary metabolite

1 reference

https://reactome.org/PathwayBrowser/#/R-HSA-1430728&DTAB=MT

336.23005950399994 dalton

1 reference

based on heuristic

inferred from isomeric SMILES

chemical formula

C₂₀H₃₂O₄

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CCCCCC=CCC1OC1C=CC(O)CC=CCCCC(=O)O

1 reference

based on heuristic

inferred from isomeric SMILES

isomeric SMILES

C(CCC/C=C\CC(O)/C=C/[C@@H]1O[C@H]1C/C=C\CCCCC)(=O)O

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Identifiers

InChI=1S/C20H32O4/c1-2-3-4-5-6-10-13-18-19(24-18)16-15-17(21)12-9-7-8-11-14-20(22)23/h6-7,9-10,15-19,21H,2-5,8,11-14H2,1H3,(H,22,23)/b9-7-,10-6-,16-15+/t17?,18-,19-/m0/s1

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SGTUOBURCVMACZ-SEVPPISGSA-N

1 reference

ChEBI release 2020-09-01

1 reference

matched by identifier from

SGTUOBURCVMACZ-SEVPPISGSA-N

mapping relation type

2 references

ChEBI release 2019-10-02

matched by identifier from

International Chemical Identifier

InChI=1S/C20H32O4/c1-2-3-4-5-6-10-13-18-19(24-18)16-15-17(21)12-9-7-8-11-14-20(22)23/h6-7,9-10,15-19,21H,2-5,8,11-14H2,1H3,(H,22,23)/b9-7-,10-6-,16-15+/t17?,18-,19-/m0/s1

UniChem compound ID

1 reference

1 reference

matched by identifier from

SGTUOBURCVMACZ-SEVPPISGSA-N

0 references

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