(Q82187473)

English

CTK1A1610

chemical compound

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instance of

type of chemical entity

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subclass of

7-[2-(3-Hydroxyoct-1-enyl)-5-oxocyclopent-3-en-1-yl]heptanoic acid

1 reference

based on heuristic

inferred from InChIKey

mass

336.23005950399994 dalton

1 reference

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

7-[(1R,2S)-2-[(E,3R)-3-hydroxyoct-1-enyl]-5-oxocyclopent-3-en-1-yl]heptanoic acid

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(8S,12S)-15S-hydroxy-9-oxoprosta-10Z,13E-dien-1-oic acid

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

7-[(1R,2S)-2-[(3S)-3-hydroxyoct-1-enyl]-5-oxo-1-cyclopent-3-enyl]heptanoic acid

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₃₂O₄

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CCCCCC(O)C=CC1C=CC(=O)C1CCCCCCC(=O)O

1 reference

based on heuristic

inferred from isomeric SMILES

isomeric SMILES

CCCCC[C@H](O)C=C[C@H]1C=CC(=O)[C@H]1CCCCCCC(=O)O

1 reference

based on heuristic

inferred from InChI

Identifiers

InChI

InChI=1S/C20H32O4/c1-2-3-6-9-17(21)14-12-16-13-15-19(22)18(16)10-7-4-5-8-11-20(23)24/h12-18,21H,2-11H2,1H3,(H,23,24)/t16-,17-,18-/m0/s1

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InChIKey

BGKHCLZFGPIKKU-BZSNNMDCSA-N

0 references

0 references

2 references

26 December 2021

matched by identifier from

InChIKey

BGKHCLZFGPIKKU-BZSNNMDCSA-N

1 reference

1 reference

matched by identifier from

InChIKey

BGKHCLZFGPIKKU-BZSNNMDCSA-N

DSSTOX compound identifier

DTXCID80341448

0 references

(Q82187473)

CTK1A1610

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Identifiers

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