CITRONELLAL

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C10H18O
Molecular Weight	154.2493
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of CITRONELLAL

Structure Search

SMILES

CC(CCC=C(C)C)CC=O

InChI

InChIKey=NEHNMFOYXAPHSD-UHFFFAOYSA-N

InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,8,10H,4,6-7H2,1-3H3

HIDE SMILES / InChI

Molecular Formula	C10H18O
Molecular Weight	154.2493
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 17:02:19 UTC 2023` Edited by `admin` on `Fri Dec 15 17:02:19 UTC 2023`
Record UNII	QB99VZZ7GZ
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

CITRONELLAL

Official Name

English

CITRONELLAL [MI]

Common Name

English

CITRONELLAL [INCI]

Common Name

English

CITRONELLAL [FCC]

Common Name

English

RHODINAL

Systematic Name

English

POLY((1,3A,4,6,7,7A-HEXAHYDRO-1,3-DIOXO-3H-FURO(3,4-C)PYRAN-4,6-DIYL)(TETRAHYDRO-2,5-DIOXO-3,4-FURANDIYL)METHYLENE)

Common Name

English

3,7-DIMETHYLOCT-6-EN-1-AL

Systematic Name

English

CITRONELLAL [FHFI]

Common Name

English

6-OCTENAL, 3,7-DIMETHYL-

Systematic Name

English

(±)-CITRONELLAL

Systematic Name

English

NSC-46106

Code

English

FEMA NO. 2307

Code

English

CITRONELLAL [HSDB]

Common Name

English

3,7-DIMETHYL-6-OCTENAL

Systematic Name

English

Classification Tree Code System Code

JECFA EVALUATION

CITRONELLAL

Created by admin on Fri Dec 15 17:02:19 UTC 2023 , Edited by admin on Fri Dec 15 17:02:19 UTC 2023

CFR

21 CFR 172.515

Created by admin on Fri Dec 15 17:02:19 UTC 2023 , Edited by admin on Fri Dec 15 17:02:19 UTC 2023

Code System Code Type Description

SMS_ID

300000021793

Created by admin on Fri Dec 15 17:02:19 UTC 2023 , Edited by admin on Fri Dec 15 17:02:19 UTC 2023

PRIMARY

ECHA (EC/EINECS)

203-376-6

Created by admin on Fri Dec 15 17:02:19 UTC 2023 , Edited by admin on Fri Dec 15 17:02:19 UTC 2023

PRIMARY

EPA CompTox

DTXSID3041790

Created by admin on Fri Dec 15 17:02:19 UTC 2023 , Edited by admin on Fri Dec 15 17:02:19 UTC 2023

PRIMARY

WIKIPEDIA

CITRONELLAL

Created by admin on Fri Dec 15 17:02:19 UTC 2023 , Edited by admin on Fri Dec 15 17:02:19 UTC 2023

PRIMARY

PUBCHEM

7794

Created by admin on Fri Dec 15 17:02:19 UTC 2023 , Edited by admin on Fri Dec 15 17:02:19 UTC 2023

PRIMARY

CAS

106-23-0

Created by admin on Fri Dec 15 17:02:19 UTC 2023 , Edited by admin on Fri Dec 15 17:02:19 UTC 2023

PRIMARY

DAILYMED

QB99VZZ7GZ

Created by admin on Fri Dec 15 17:02:19 UTC 2023 , Edited by admin on Fri Dec 15 17:02:19 UTC 2023

PRIMARY

CHEBI

47856

Created by admin on Fri Dec 15 17:02:19 UTC 2023 , Edited by admin on Fri Dec 15 17:02:19 UTC 2023

PRIMARY

MESH

C108217

Created by admin on Fri Dec 15 17:02:19 UTC 2023 , Edited by admin on Fri Dec 15 17:02:19 UTC 2023

PRIMARY

HSDB

594

Created by admin on Fri Dec 15 17:02:19 UTC 2023 , Edited by admin on Fri Dec 15 17:02:19 UTC 2023

PRIMARY

JECFA MONOGRAPH

1229

Created by admin on Fri Dec 15 17:02:19 UTC 2023 , Edited by admin on Fri Dec 15 17:02:19 UTC 2023

PRIMARY

MERCK INDEX

m3598

Created by admin on Fri Dec 15 17:02:19 UTC 2023 , Edited by admin on Fri Dec 15 17:02:19 UTC 2023

PRIMARY

Merck Index

FDA UNII

QB99VZZ7GZ

Created by admin on Fri Dec 15 17:02:19 UTC 2023 , Edited by admin on Fri Dec 15 17:02:19 UTC 2023

PRIMARY

NSC

46106

Created by admin on Fri Dec 15 17:02:19 UTC 2023 , Edited by admin on Fri Dec 15 17:02:19 UTC 2023

PRIMARY

RXCUI

1424876

Created by admin on Fri Dec 15 17:02:19 UTC 2023 , Edited by admin on Fri Dec 15 17:02:19 UTC 2023

PRIMARY

RxNorm

Related Record Type Details


					DBD92X468R

JAVA CITRONELLA OIL

PARENT -> CONSTITUENT ALWAYS PRESENT

Interaction Type:

ASSAY (GC)

Amount: