VALERENIC ACID

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NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C15H22O2
Molecular Weight	234.334
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of VALERENIC ACID

Structure Search

SMILES

[H][C@]12CCC(C)=C1[C@@H](CC[C@H]2C)\C=C(/C)C(O)=O

InChI

InChIKey=FEBNTWHYQKGEIQ-SUKRRCERSA-N

InChI=1S/C15H22O2/c1-9-4-6-12(8-11(3)15(16)17)14-10(2)5-7-13(9)14/h8-9,12-13H,4-7H2,1-3H3,(H,16,17)/b11-8+/t9-,12+,13-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C15H22O2
Molecular Weight	234.334
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Patents

Patents

Substance Class	Chemical Created by `admin` on `Sat Dec 16 06:08:25 UTC 2023` Edited by `admin` on `Sat Dec 16 06:08:25 UTC 2023`
Record UNII	34NDB285PM
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

VALERENIC ACID

Common Name

English

VALERENIC ACID (CONSTITUENT OF VALERIAN) [DSC]

Common Name

English

2-PROPENOIC ACID, 3-((4S,7R,7AR)-2,4,5,6,7,7A-HEXAHYDRO-3,7-DIMETHYL-1H-INDEN-4-YL)-2-METHYL-, (2E)-

Common Name

English

(2E)-3-((4S,7R,7AR)-3,7-DIMETHYL-2,4,5,6,7,7A-HEXAHYDRO-1H-INDEN-4-YL)-2-METHYLACRYLIC ACID

Common Name

English

VALERENIC ACID [USP-RS]

Common Name

English

(-)-VALERENIC ACID

Common Name

English

Classification Tree Code System Code

DSLD

2784 (Number of products:7)

Created by admin on Sat Dec 16 06:08:26 UTC 2023 , Edited by admin on Sat Dec 16 06:08:26 UTC 2023

Code System Code Type Description

RS_ITEM_NUM

1707908

Created by admin on Sat Dec 16 06:08:26 UTC 2023 , Edited by admin on Sat Dec 16 06:08:26 UTC 2023

PRIMARY

EPA CompTox

DTXSID8034089

Created by admin on Sat Dec 16 06:08:26 UTC 2023 , Edited by admin on Sat Dec 16 06:08:26 UTC 2023

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PUBCHEM

6440940

Created by admin on Sat Dec 16 06:08:26 UTC 2023 , Edited by admin on Sat Dec 16 06:08:26 UTC 2023

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CAS

3569-10-6

Created by admin on Sat Dec 16 06:08:26 UTC 2023 , Edited by admin on Sat Dec 16 06:08:26 UTC 2023

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CHEBI

9921

Created by admin on Sat Dec 16 06:08:26 UTC 2023 , Edited by admin on Sat Dec 16 06:08:26 UTC 2023

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SMS_ID

300000032614

Created by admin on Sat Dec 16 06:08:26 UTC 2023 , Edited by admin on Sat Dec 16 06:08:26 UTC 2023

PRIMARY

FDA UNII

34NDB285PM

Created by admin on Sat Dec 16 06:08:26 UTC 2023 , Edited by admin on Sat Dec 16 06:08:26 UTC 2023

PRIMARY

WIKIPEDIA

VALERENIC ACID

Created by admin on Sat Dec 16 06:08:26 UTC 2023 , Edited by admin on Sat Dec 16 06:08:26 UTC 2023

PRIMARY

Related Record Type Details


					JWF5YAW3QW

VALERIAN

PARENT -> CONSTITUENT ALWAYS PRESENT

Qualification:

USP

Amount: