3',4'-DIDEHYDRO-.BETA.,.BETA.-CAROTEN-4-ONE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C40H52O
Molecular Weight	548.8403
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	9
Charge	0

SHOW SMILES / InChI

Structure of 3',4'-DIDEHYDRO-.BETA.,.BETA.-CAROTEN-4-ONE

Structure Search

SMILES

CC(\C=C\C=C(C)\C=C\C1=C(C)C=CCC1(C)C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C2=C(C)C(=O)CCC2(C)C

InChI

InChIKey=ROUDKXHBGQMOSU-QQGJMDNJSA-N

InChI=1S/C40H52O/c1-30(18-13-20-32(3)23-25-36-34(5)22-15-28-39(36,7)8)16-11-12-17-31(2)19-14-21-33(4)24-26-37-35(6)38(41)27-29-40(37,9)10/h11-26H,27-29H2,1-10H3/b12-11+,18-13+,19-14+,25-23+,26-24+,30-16+,31-17+,32-20+,33-21+

HIDE SMILES / InChI

Molecular Formula	C40H52O
Molecular Weight	548.8403
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	9
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 20:35:38 GMT 2025` Edited by `admin` on `Tue Apr 01 20:35:38 GMT 2025`
Record UNII	UFA7886U28
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3',4'-DIDEHYDRO-.BETA.,.BETA.-CAROTEN-4-ONE

Common Name

English

.BETA.,.BETA.-CAROTEN-4-ONE, 3',4'-DIDEHYDRO-

Preferred Name

English

3',4'-DIDEHYDRO-BETA-CAROTEN-4-ONE

Common Name

English

3',4'-DIDEHYDRO-.BETA.-CAROTEN-4-ONE-

Common Name

English

2,4,4-TRIMETHYL-3-((1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-TETRAMETHYL-18-(2,6,6-TRIMETHYLCYCLOHEXA-1,3-DIEN-1-YL)OCTADECA-1,3,5,7,9,11,13,15,17-NONAENYL)CYCLOHEX-2-EN-1-ONE

Systematic Name

English

.BETA.-CAROTEN-4-ONE, 3',4'-DIDEHYDRO-

Common Name

English

Code System Code Type Description

CAS

991-90-2

Created by admin on Tue Apr 01 20:35:38 GMT 2025 , Edited by admin on Tue Apr 01 20:35:38 GMT 2025

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PUBCHEM

87443235

Created by admin on Tue Apr 01 20:35:38 GMT 2025 , Edited by admin on Tue Apr 01 20:35:38 GMT 2025

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FDA UNII

UFA7886U28

Created by admin on Tue Apr 01 20:35:38 GMT 2025 , Edited by admin on Tue Apr 01 20:35:38 GMT 2025

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