(Q63398816)

English

(Z)-7-[(1S,2S,3S,5R)-3,5-dihydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]cyclopentyl]hept-5-enoic acid

chemical compound

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instance of

type of chemical entity

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subclass of

isoprostane

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mass

354.2406241879999 dalton

1 reference

based on heuristic

inferred from isomeric SMILES

stereoisomer of

9R,11S,15S-trihydroxy-5Z,13E-prostadienoic acid-cyclo[8R,12R]

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

9R,11S,15R-trihydroxy-5Z,13E-prostadienoic acid-cyclo[8R,12S]

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

11-epi-prostaglandin F2alpha

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

9R,11S,15R-trihydroxy-5Z,13E-prostadienoic acid-cyclo[8R,12R]

2 references

based on heuristic

inferred from InChIKey

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

9S,11R,15R-trihydroxy-5Z,13E-prostadienoic acid-cyclo[8S,12S]

1 reference

based on heuristic

inferred from InChIKey

7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(1E,3S)-3-hydroxyoct-1-en-1-yl]cyclopentyl]hept-5-enoic acid

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

9R,11S,15R-trihydroxy-5Z,13E-prostadienoic acid-cyclo[8S,12R]

1 reference

based on heuristic

inferred from InChIKey

(8beta,9alpha,11alpha,15R)-9,11,15-Trihydroxyprosta-5,13-dien-1-oic acid

2 references

based on heuristic

inferred from InChIKey

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

9R,11S,15R-trihydroxy-5Z,13E-prostadienoic acid-cyclo[8S,12S]

2 references

based on heuristic

inferred from InChIKey

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

(Z)-7-[(1S,2S,3R,5S)-3,5-dihydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]cyclopentyl]hept-5-enoic acid

1 reference

1 reference

9S,11R,15S-trihydroxy-5Z,13E-prostadienoic acid-cyclo[8R,12S]

1 reference

based on heuristic

inferred from InChI

(Z)-7-[(1S,2R,3S,5R)-3,5-dihydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]cyclopentyl]hept-5-enoic acid

1 reference

based on heuristic

inferred from InChI

9R,11R,15S-trihydroxy-5Z,13E-prostadienoic acid-cyclo[8S,12R]

1 reference

based on heuristic

inferred from InChI

(Z)-7-((1R,2R,3R,5R)-3,5-dihydroxy-2-((S,E)-3-hydroxyoct-1-enyl)cyclopentyl)hept-5-enoic acid

1 reference

based on heuristic

inferred from InChI

8-epi-prostaglandin F2alpha

1 reference

based on heuristic

inferred from InChI

(E)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]cyclopentyl]hept-5-enoic acid

1 reference

based on heuristic

inferred from InChI

9R,11S,15S-trihydroxy-5Z,13E-prostadienoic acid-cyclo[8R,12S]

1 reference

1 reference

9S,11R,15R-trihydroxy-5Z,13E-prostadienoic acid-cyclo[8R,12S]

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₃₄O₅

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canonical SMILES

CCCCCC(O)C=CC1C(O)CC(O)C1CC=CCCCC(=O)O

1 reference

based on heuristic

inferred from isomeric SMILES

isomeric SMILES

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

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Identifiers

InChI

InChI=1S/C20H34O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h4,7,12-13,15-19,21-23H,2-3,5-6,8-11,14H2,1H3,(H,24,25)/b7-4-,13-12 /t15-,16-,17-,18 ,19-/m0/s1

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InChIKey

PXGPLTODNUVGFL-GTXDYMSZSA-N

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PubChem CID

52195750

1 reference

matched by identifier from

InChIKey

PXGPLTODNUVGFL-GTXDYMSZSA-N

1 reference

MassBank accession ID

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1 reference

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

retrieved

30 June 2018

(Q63398816)

(Z)-7-[(1S,2S,3S,5R)-3,5-dihydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]cyclopentyl]hept-5-enoic acid

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