trans-linalool oxide (Q27272093)

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chemical compound

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Language	Label	Description	Also known as
English	trans-linalool oxide	chemical compound

Statements

instance of

type of chemical entity

0 references

subclass of

2,6-dimethyloctane monoterpenoid

0 references

mass

170.131±0 dalton

1 reference

stated in

PubChem

PubChem CID

6432254

language of work or name

English

title

Linalool A oxide (English)

retrieved

14 October 2016

stereoisomer of

2-Furanmethanol, 5-ethenyltetrahydro-alpha,alpha,5-trimethyl-, cis-

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

cis-linalool oxide

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

2-Furanmethanol, 5-ethenyltetrahydro-alpha,alpha,5-trimethyl-, (2R,5R)-rel-

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₀H₁₈O₂

1 reference

stated in

PubChem

PubChem CID

6432254

language of work or name

English

title

Linalool A oxide (English)

retrieved

14 October 2016

canonical SMILES

CC1(CCC(O1)C(C)(C)O)C=C

1 reference

stated in

PubChem

PubChem CID

6432254

language of work or name

English

title

Linalool A oxide (English)

retrieved

14 October 2016

isomeric SMILES

C[C@]1(CC[C@H](O1)C(C)(C)O)C=C

1 reference

stated in

PubChem

PubChem CID

6432254

language of work or name

English

title

Linalool A oxide (English)

retrieved

14 October 2016

found in taxon

Myrtus communis L.

1 reference

stated in

Gas chromatographic—mass spectrometric investigations of the volatile components of myrtle berries (Myrtus communis L.)

Citrus ×iyo

1 reference

stated in

Composition of oxygenated compounds in peel oil from Citrus iyo and its variation during storage.

Hesperis matronalis

2 references

stated in

Flower color-flower scent associations in polymorphic Hesperis matronalis (Brassicaceae)

stated in

Asynchronous rhythms in the emission of volatiles from Hesperis matronalis flowers

Thymus camphoratus

1 reference

stated in

Composition and infraspecific variability of essential oil from Thymus camphoratus

Rhodiola rosea

1 reference

stated in

Volatiles from rhizomes of Rhodiola rosea L.

Acorus calamus

1 reference

stated in

Composition of Essential Oil of Sweet Flag (Acorus calamus L.) Leaves at Different Growing Phases

Mangifera indica

2 references

stated in

Glycosidically-bound aroma volatile compounds in the skin and pulp of ‘Kensington Pride’ mango fruit at different stages of maturity

stated in

Characteristic Aroma Components of the Volatile Oil of Yellow Keaw Mango Fruits Determined by Limited Odor Unit Method.

Chamaemelum nobile

1 reference

stated in

Chemical Constituents and Antioxidant Properties of Matricaria recutita and Chamaemelum nobile Essential Oil Growing Wild in the South West of Iran

Matricaria chamomilla

1 reference

stated in

Propagation Method and Distillation Apparatus Type Affect Essential Oil from Different Parts of Matricaria recutita L. Plants

Chamomilla recutita

1 reference

stated in

Propagation Method and Distillation Apparatus Type Affect Essential Oil from Different Parts of Matricaria recutita L. Plants

Carica papaya

1 reference

stated in

Volatile components of papaya (Carica papaya L., Maradol variety) fruit

Garcinia dulcis

1 reference

stated in

Volatile constituents of fruits of Garcinia dulcis Kurz. from Cuba

Cornus officinalis

1 reference

stated in

Volatile Flavor Components of CORNI FRUCTUS (Cornus officinalis Sieb. et Zucc.)

basil

1 reference

stated in

Chemical characterization and genetic relationships among Ocimum basilicum L. cultivars

Perilla frutescens

1 reference

stated in

Essential oils of green and red Perilla frutescens as potential sources of compounds for mosquito management

tomato

1 reference

stated in

Determination of Volatile Organic Compounds in Andean Tomato Landraces by Headspace Solid Phase Microextraction-Gas Chromatography-Mass Spectrometry

Camellia sinensis

1 reference

stated in

Metabolite profiling of Camellia sinensis by automated sequential, multidimensional gas chromatography/mass spectrometry reveals strong monsoon effects on tea constituents

Vachellia rigidula

1 reference

stated in

Volatile components of Acacia sp. blossoms

Identifiers

InChI

InChI=1S/C10H18O2/c1-5-10(4)7-6-8(12-10)9(2,3)11/h5,8,11H,1,6-7H2,2-4H3/t8-,10+/m0/s1

1 reference

stated in

PubChem

PubChem CID

6432254

language of work or name

English

title

Linalool A oxide (English)

retrieved

14 October 2016

InChIKey

BRHDDEIRQPDPMG-WCBMZHEXSA-N

1 reference

stated in

PubChem

PubChem CID

6432254

language of work or name

English

title

Linalool A oxide (English)

retrieved

14 October 2016

CAS Registry Number

34995-77-2

2 references

stated in

Global Substance Registration System

UNII

986J3104O2

language of work or name

English

title

trans-linalool oxide (English)

retrieved

14 October 2016

InChIKey

BRHDDEIRQPDPMG-WCBMZHEXSA-N

stated in

CAS Common Chemistry

retrieved

9 April 2021

reference URL

https://commonchemistry.cas.org/detail?cas_rn=34995-77-2

ChemSpider ID

4937513

1 reference

stated in

ChemSpider

ChemSpider ID

4937513

language of work or name

English

title

a-Linalyl oxide (English)

retrieved

14 October 2016

PubChem CID

6432254

2 references

stated in

PubChem

PubChem CID

6432254

language of work or name

English

title

Linalool A oxide (English)

retrieved

14 October 2016

matched by identifier from

InChIKey

InChIKey

BRHDDEIRQPDPMG-WCBMZHEXSA-N

ChEBI ID

177374

mapping relation type

exact match

2 references

stated in

ChEBI release 2022-06-13

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C10H18O2/c1-5-10(4)7-6-8(12-10)9(2,3)11/h5,8,11H,1,6-7H2,2-4H3/t8-,10+/m0/s1

ChEMBL ID

CHEMBL2252947

1 reference

stated in

ChEMBL

ChEMBL ID

CHEMBL2252947

language of work or name

English

title

(E)-LINALOOL OXIDE (English)

retrieved

14 October 2016

SureChEMBL ID

SCHEMBL1116444

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

BRHDDEIRQPDPMG-WCBMZHEXSA-N

UniChem compound ID

10197370

1 reference

stated in

UniChem

MassBank accession ID

MSBNK-Fac_Eng_Univ_Tokyo-JP008389

0 references

SPLASH

splash10-052f-9000000000-e8c8defcb13d413ce23b

0 references

DSSTox substance ID

DTXSID60884808

0 references

DSSTOX compound identifier

DTXCID801024229

0 references

EC number

252-312-3

1 reference

stated in

Global Substance Registration System

UNII

986J3104O2

language of work or name

English

title

trans-linalool oxide (English)

retrieved

14 October 2016

ECHA Substance Infocard ID

100.047.542

1 reference

stated in

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.047.542

retrieved

27 December 2018

title

Tetrahydro-α,α,5-trimethyl-5-vinylfuran-2-methanol (English)

quotation

CAS no.: 34995-77-2 (English)

CosIng number

41052

1 reference

stated in

CosIng database

CosIng number

41052

retrieved

28 December 2019

title

TETRAHYDRO-TRIMETHYL-5-VINYLFURAN-2-METHANOL (English)

quotation

CAS no.: 34995-77-2 (English)

Cannabis Database ID

000294

1 reference

stated in

Cannabis Database

Human Metabolome Database ID

HMDB0040727

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

BRHDDEIRQPDPMG-WCBMZHEXSA-N

UNII

986J3104O2

2 references

stated in

Global Substance Registration System

UNII

986J3104O2

language of work or name

English

title

trans-linalool oxide (English)

retrieved

14 October 2016

matched by identifier from

InChIKey

InChIKey

BRHDDEIRQPDPMG-WCBMZHEXSA-N

 

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