HYDROXYVALERENIC ACID

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C15H22O3
Molecular Weight	250.3334
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

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

InChI

InChIKey=XJNQXTISSHEQKD-UNXUOHHUSA-N

InChI=1S/C15H22O3/c1-8-4-5-11(6-10(3)15(17)18)13-9(2)7-12(16)14(8)13/h6,8,11-12,14,16H,4-5,7H2,1-3H3,(H,17,18)/b10-6+/t8-,11+,12-,14+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C15H22O3
Molecular Weight	250.3334
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:46:35 UTC 2023` Edited by `admin` on `Sat Dec 16 09:46:35 UTC 2023`
Record UNII	043W90DL5F
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

HYDROXYVALERENIC ACID

Common Name

English

HYDROXYVALERENIC ACID (CONSTITUENT OF VALERIAN) [DSC]

Common Name

English

VALERENOLIC ACID

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID8033564

Created by admin on Sat Dec 16 09:46:35 UTC 2023 , Edited by admin on Sat Dec 16 09:46:35 UTC 2023

PRIMARY

PUBCHEM

6537505

Created by admin on Sat Dec 16 09:46:35 UTC 2023 , Edited by admin on Sat Dec 16 09:46:35 UTC 2023

PRIMARY

FDA UNII

043W90DL5F

Created by admin on Sat Dec 16 09:46:35 UTC 2023 , Edited by admin on Sat Dec 16 09:46:35 UTC 2023

PRIMARY

CAS

1619-16-5

Created by admin on Sat Dec 16 09:46:35 UTC 2023 , Edited by admin on Sat Dec 16 09:46:35 UTC 2023

PRIMARY

Related Record Type Details


					JWF5YAW3QW

VALERIAN

PARENT -> CONSTITUENT ALWAYS PRESENT

Qualification:

USP

Amount: