13-ALDOPHOMENONE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C15H18O4
Molecular Weight	262.301
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C[C@H]1[C@H](O)CCC2=CC(=O)[C@@]3(O[C@@H]3[C@]12C)C(=C)C=O

InChI

InChIKey=WGEWVFQWCJKYNY-OANMRLRGSA-N

InChI=1S/C15H18O4/c1-8(7-16)15-12(18)6-10-4-5-11(17)9(2)14(10,3)13(15)19-15/h6-7,9,11,13,17H,1,4-5H2,2-3H3/t9-,11+,13+,14+,15-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C15H18O4
Molecular Weight	262.301
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 18:55:29 GMT 2025` Edited by `admin` on `Mon Mar 31 18:55:29 GMT 2025`
Record UNII	08206504B0
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

J304.403C

Preferred Name

English

13-ALDOPHOMENONE

Common Name

English

NAPHTH(1,2-B)OXIRENE-1A(2H)-ACETALDEHYDE, 4,5,6,7,7A,7B-HEXAHYDRO-6-HYDROXY-7,7A-DIMETHYL-.ALPHA.-METHYLENE-2-OXO-, (1AR-(1A.ALPHA.,6.BETA.,7.ALPHA.,7A.ALPHA.,7B.ALPHA.))-

Systematic Name

English

(+)-13-ALDOPHOMENONE

Common Name

English

(1AR)-4,5,6,7,7A,7B.ALPHA.-HEXAHYDRO-6.BETA.-HYDROXY-1A.ALPHA.(1-FORMYLETHENYL)-7.ALPHA.,7A.ALPHA.-DIMETHYLNAPHTH(1,2-B)OXIREN-2(1AH)-ONE

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID00241633

Created by admin on Mon Mar 31 18:55:29 GMT 2025 , Edited by admin on Mon Mar 31 18:55:29 GMT 2025

PRIMARY

PUBCHEM

178769

Created by admin on Mon Mar 31 18:55:29 GMT 2025 , Edited by admin on Mon Mar 31 18:55:29 GMT 2025

PRIMARY

CAS

94816-66-7

Created by admin on Mon Mar 31 18:55:29 GMT 2025 , Edited by admin on Mon Mar 31 18:55:29 GMT 2025

PRIMARY

FDA UNII

08206504B0

Created by admin on Mon Mar 31 18:55:29 GMT 2025 , Edited by admin on Mon Mar 31 18:55:29 GMT 2025

PRIMARY