(Q106038787)

English

17S,(16)-epoxy-(4Z,7Z,10Z,13Z,19Z)-docosahexa-4,7,10,13,15,19-enoic acid

chemical compound

(4Z,7Z,10Z,13Z)-15-{(3S)-3-[(2Z)-pent-2-en-1-yl]oxiran-2-ylidene}pentadeca-4,7,10,13-tetraenoic acid

In more languages

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No description defined

Statements

type of chemical entity

0 references

chemical compound

0 references

342.21949481999997 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

17R,(16)-epoxy-(4Z,7Z,10Z,13Z,19Z)-docosahexa-4,7,10,13,15,19-enoic acid

1 reference

based on heuristic

inferred from InChIKey

chemical formula

C₂₂H₃₀O₃

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CCC=CCC1OC1=CC=CCC=CCC=CCC=CCCC(=O)O

1 reference

based on heuristic

inferred from isomeric SMILES

isomeric SMILES

CC/C=C\C[C@@H]1O/C1=C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)O

1 reference

based on heuristic

inferred from InChI

Identifiers

InChI=1S/C22H30O3/c1-2-3-14-17-20-21(25-20)18-15-12-10-8-6-4-5-7-9-11-13-16-19-22(23)24/h3,5-8,11-15,18,20H,2,4,9-10,16-17,19H2,1H3,(H,23,24)/b7-5-,8-6-,13-11-,14-3-,15-12-,21-18+/t20-/m0/s1

1 reference

ChEBI release 2021-03-01

GNNVMCUWAZZAPX-BINUBKNQSA-N

1 reference

ChEBI release 2021-03-01

2 references

ChEBI release 2021-03-01

matched by identifier from

GNNVMCUWAZZAPX-BINUBKNQSA-N

mapping relation type

2 references

ChEBI release 2021-03-01

matched by identifier from

International Chemical Identifier

InChI=1S/C22H30O3/c1-2-3-14-17-20-21(25-20)18-15-12-10-8-6-4-5-7-9-11-13-16-19-22(23)24/h3,5-8,11-15,18,20H,2,4,9-10,16-17,19H2,1H3,(H,23,24)/b7-5-,8-6-,13-11-,14-3-,15-12-,21-18+/t20-/m0/s1

UniChem compound ID

1 reference

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