(Q82143795)

English

CTK1J1717

chemical compound

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Statements

type of chemical entity

0 references

chemical compound

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204.187800768 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

Caryophyllene (z-)

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(Z)-caryophyllene

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(1R,4Z,9R)-4,11,11-Trimethyl-8-methylenebicyclo[7.2.0]undec-4-ene

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

Bicyclo(7.2.0)undec-4-ene, 4,11,11-trimethyl-8-methylene-, (1S,4E,9R)-

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(E)-2-epi-beta-caryophyllene

1 reference

based on heuristic

inferred from InChI

(+)-beta-caryophyllene

1 reference

based on heuristic

inferred from InChI

Bicyclo[7.2.0]undec-4-ene, 4,11,11-trimethyl-8-methylene-, (1R,4E,9S)-

1 reference

based on heuristic

inferred from InChI

isocaryophyllene

1 reference

based on heuristic

inferred from InChI

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₅H₂₄

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

C=C1CCC=C(C)CCC2C1CC2(C)C

1 reference

based on heuristic

inferred from isomeric SMILES

isomeric SMILES

C=C1CCC=C(C)CC[C@@H]2[C@H]1CC2(C)C

1 reference

based on heuristic

inferred from InChI

Identifiers

InChI=1S/C15H24/c1-11-6-5-7-12(2)13-10-15(3,4)14(13)9-8-11/h6,13-14H,2,5,7-10H2,1,3-4H3/t13-,14+/m0/s1

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NPNUFJAVOOONJE-UONOGXRCSA-N

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CAS Registry Number

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1 reference

26 December 2021

UniChem compound ID

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DSSTox substance ID

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DSSTOX compound identifier

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Sitelinks

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Wiktionary(0 entries)

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