BOONEIN

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C9H14O3
Molecular Weight	170.2057
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of BOONEIN

Structure Search

SMILES

C[C@H]1[C@@H](O)C[C@@H]2CCOC(=O)[C@H]12

InChI

InChIKey=WJMOFJJTTHNUOH-DKXJUACHSA-N

InChI=1S/C9H14O3/c1-5-7(10)4-6-2-3-12-9(11)8(5)6/h5-8,10H,2-4H2,1H3/t5-,6-,7-,8+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C9H14O3
Molecular Weight	170.2057
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 12:02:17 GMT 2025` Edited by `admin` on `Wed Apr 02 12:02:17 GMT 2025`
Record UNII	WC2BAD993T
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

BOONEIN

Common Name

English

(4AS,6S,7R,7AS)-HEXAHYDRO-6-HYDROXY-7-METHYLCYCLOPENTA(C)PYRAN-1(3H)-ONE

Preferred Name

English

CYCLOPENTA(C)PYRAN-1(3H)-ONE, HEXAHYDRO-6-HYDROXY-7-METHYL-, (4AS-(4A.ALPHA.,6.ALPHA.,7.ALPHA.,7A.ALPHA.))-

Systematic Name

English

Code System Code Type Description

WIKIPEDIA

Boonein

Created by admin on Wed Apr 02 12:02:17 GMT 2025 , Edited by admin on Wed Apr 02 12:02:17 GMT 2025

PRIMARY

PUBCHEM

17747980

Created by admin on Wed Apr 02 12:02:17 GMT 2025 , Edited by admin on Wed Apr 02 12:02:17 GMT 2025

PRIMARY

CAS

85502-19-8

Created by admin on Wed Apr 02 12:02:17 GMT 2025 , Edited by admin on Wed Apr 02 12:02:17 GMT 2025

PRIMARY

EPA CompTox

DTXSID601045528

Created by admin on Wed Apr 02 12:02:17 GMT 2025 , Edited by admin on Wed Apr 02 12:02:17 GMT 2025

PRIMARY

FDA UNII

WC2BAD993T

Created by admin on Wed Apr 02 12:02:17 GMT 2025 , Edited by admin on Wed Apr 02 12:02:17 GMT 2025

PRIMARY