(Q72485409)

English

trans-(+)-isolimonene

chemical compound

(+)-(1R,4R)-trans-Isolimonene
(+)-trans-1-Methyl-4-isopropenyl-2-cyclohexene
(+)-trans-Isolimonene
(1R)-(+)-trans-Isolimonene
(1R,4R)-Isolimonene
Isolimonene
(3R,6R)-3-methyl-6-prop-1-en-2-ylcyclohexene

In more languages

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Statements

instance of

type of chemical entity

0 references

0 references

1 reference

http://citeseerx.ist.psu.edu/viewdoc/download?doi=10.1.1.619.4803&rep=rep1&type=pdf

mass

136.125200512 dalton

1 reference

1 reference

C₁₀H₁₆

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canonical SMILES

CC1CCC(C=C1)C(=C)C

1 reference

language of work or name

English

title

Isolimonene (English)

retrieved

21 September 2016

isomeric SMILES

C[C@@H]1CC[C@H](C=C1)C(=C)C

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found in taxon

Nicotiana tabacum

1 reference

stated in

Extraction of essential oil from discarded tobacco leaves by solvent extraction and steam distillation, and identification of its chemical composition

subject has role

pollutant

1 reference

reference URL

http://www.sciencedirect.com/science/article/pii/S0045653509002665

metabolite

of

Homo sapiens

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Identifiers

InChI

InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,6,9-10H,1,5,7H2,2-3H3/t9-,10-/m0/s1

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InChIKey

TWCNAXRPQBLSNO-UWVGGRQHSA-N

1 reference

stated in

ChEBI release 2020-09-01

CAS Registry Number

5113-87-1

1 reference

InChIKey

TWCNAXRPQBLSNO-UWVGGRQHSA-N

8 April 2021

https://commonchemistry.cas.org/detail?cas_rn=5113-87-1

PubChem CID

78790

1 reference

matched by identifier from

InChIKey

TWCNAXRPQBLSNO-UWVGGRQHSA-N

ChEBI ID

90014

mapping relation type

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1 reference

2 references

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

matched by identifier from

InChIKey

TWCNAXRPQBLSNO-UWVGGRQHSA-N

DSSTOX compound identifier

DTXCID00121643

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EC number

225-843-3

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ECHA Substance Infocard ID

100.023.494

1 reference

stated in

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.023.494

retrieved

29 December 2019

title

(3R-trans)-3-methyl-6-(1-methylvinyl)cyclohexene (English)

quotation

CAS no.: 5113-87-1 (English)

1 reference

Human Metabolome Database ID

HMDB0061793

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

TWCNAXRPQBLSNO-UWVGGRQHSA-N

KNApSAcK ID

C00062010

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

TWCNAXRPQBLSNO-UWVGGRQHSA-N

(Q72485409)

trans-(+)-isolimonene

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