7-HYDROXYCITRONELLIC ACID

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NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C10H20O3
Molecular Weight	188.264
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 7-HYDROXYCITRONELLIC ACID

Structure Search

SMILES

CC(CCCC(C)(C)O)CC(O)=O

InChI

InChIKey=LBBSPQOXZLKDOD-UHFFFAOYSA-N

InChI=1S/C10H20O3/c1-8(7-9(11)12)5-4-6-10(2,3)13/h8,13H,4-7H2,1-3H3,(H,11,12)

HIDE SMILES / InChI

Molecular Formula	C10H20O3
Molecular Weight	188.264
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 `Sat Dec 16 18:38:36 GMT 2023` Edited by `admin` on `Sat Dec 16 18:38:36 GMT 2023`
Record UNII	UR74T862RW
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

7-HYDROXYCITRONELLIC ACID

Common Name

English

7-HYDROXY-3,7-DIMETHYLOCTANOIC ACID

Systematic Name

English

CITRONELLIC ACID, HYDROXY-

Common Name

English

NSC-67874

Code

English

OCTANOIC ACID, 7-HYDROXY-3,7-DIMETHYL-

Systematic Name

English

Code System Code Type Description

NSC

67874

Created by admin on Sat Dec 16 18:38:36 GMT 2023 , Edited by admin on Sat Dec 16 18:38:36 GMT 2023

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CAS

56046-15-2

Created by admin on Sat Dec 16 18:38:36 GMT 2023 , Edited by admin on Sat Dec 16 18:38:36 GMT 2023

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FDA UNII

UR74T862RW

Created by admin on Sat Dec 16 18:38:36 GMT 2023 , Edited by admin on Sat Dec 16 18:38:36 GMT 2023

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PUBCHEM

249484

Created by admin on Sat Dec 16 18:38:36 GMT 2023 , Edited by admin on Sat Dec 16 18:38:36 GMT 2023

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EPA CompTox

DTXSID70290299

Created by admin on Sat Dec 16 18:38:36 GMT 2023 , Edited by admin on Sat Dec 16 18:38:36 GMT 2023

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