TERPENYLIC ACID

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NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C8H12O4
Molecular Weight	172.1785
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of TERPENYLIC ACID

Structure Search

SMILES

CC1(C)OC(=O)CC1CC(O)=O

InChI

InChIKey=NQWMPKJASNNZMJ-UHFFFAOYSA-N

InChI=1S/C8H12O4/c1-8(2)5(3-6(9)10)4-7(11)12-8/h5H,3-4H2,1-2H3,(H,9,10)

HIDE SMILES / InChI

Molecular Formula	C8H12O4
Molecular Weight	172.1785
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 `Mon Mar 31 22:13:45 GMT 2025` Edited by `admin` on `Mon Mar 31 22:13:45 GMT 2025`
Record UNII	9149PCO1CP
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TERPENYLIC ACID

Common Name

English

TERPENOLIC ACID

Preferred Name

English

TETRAHYDRO-5-KETO-2,2-DIMETHYL-3-FURANACETIC ACID

Systematic Name

English

3-(1-HYDROXY-1-METHYLETHYL)GLUTARIC ACID .GAMMA.-LACTONE

Systematic Name

English

3-FURANACETIC ACID, TETRAHYDRO-2,2-DIMETHYL-5-OXO-

Systematic Name

English

TERPENYLIC ACID [MI]

Common Name

English

Code System Code Type Description

PUBCHEM

117328

Created by admin on Mon Mar 31 22:13:45 GMT 2025 , Edited by admin on Mon Mar 31 22:13:45 GMT 2025

PRIMARY

EPA CompTox

DTXSID60871354

Created by admin on Mon Mar 31 22:13:45 GMT 2025 , Edited by admin on Mon Mar 31 22:13:45 GMT 2025

PRIMARY

ECHA (EC/EINECS)

247-961-4

Created by admin on Mon Mar 31 22:13:45 GMT 2025 , Edited by admin on Mon Mar 31 22:13:45 GMT 2025

PRIMARY

FDA UNII

9149PCO1CP

Created by admin on Mon Mar 31 22:13:45 GMT 2025 , Edited by admin on Mon Mar 31 22:13:45 GMT 2025

PRIMARY

CAS

116-51-8

Created by admin on Mon Mar 31 22:13:45 GMT 2025 , Edited by admin on Mon Mar 31 22:13:45 GMT 2025

PRIMARY

CAS

26754-48-3

Created by admin on Mon Mar 31 22:13:45 GMT 2025 , Edited by admin on Mon Mar 31 22:13:45 GMT 2025

ALTERNATIVE

MERCK INDEX

m955

Created by admin on Mon Mar 31 22:13:45 GMT 2025 , Edited by admin on Mon Mar 31 22:13:45 GMT 2025

PRIMARY

Merck Index

Related Record Type Details


					98P1AZ19F5

TERPENYLIC ACID MONOHYDRATE

SOLVATE->ANHYDROUS


					98P1AZ19F5

TERPENYLIC ACID MONOHYDRATE

SALT/SOLVATE -> PARENT