Chlorobactene

Details

Stereochemistry	ACHIRAL
Molecular Formula	C40H52
Molecular Weight	532.8409
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	10
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)=CCC\C(C)=C\C=C\C(C)=C\C=C\C(C)=C\C=C\C=C(C)\C=C\C=C(C)\C=C\C1=C(C)C=CC(C)=C1C

InChI

InChIKey=VJASLAGEYVTOGS-IQAIWTHGSA-N

InChI=1S/C40H52/c1-31(2)17-13-20-34(5)23-15-25-35(6)24-14-21-32(3)18-11-12-19-33(4)22-16-26-36(7)27-30-40-38(9)29-28-37(8)39(40)10/h11-12,14-19,21-30H,13,20H2,1-10H3/b12-11+,21-14+,22-16+,25-15+,30-27+,32-18+,33-19+,34-23+,35-24+,36-26+

HIDE SMILES / InChI

Molecular Formula	C40H52
Molecular Weight	532.8409
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	10
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 16:24:59 GMT 2025` Edited by `admin` on `Tue Apr 01 16:24:59 GMT 2025`
Record UNII	88JLS9ZM6C
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Chlorobacten

Preferred Name

English

Chlorobactene

Common Name

English

all-trans-Chlorobactene

Common Name

English

all-trans-Chlorobactin

Common Name

English

Chlorobactin

Common Name

English

?,?-Carotene

Common Name

English

1,3,5,7,9,11,13,15,17,19,23-Pentacosaundecaene, 3,7,12,16,20,24-hexamethyl-1-(2,3,6-trimethylphenyl)-, (all-E)-

Systematic Name

English

Chlorobactin, all-trans-

Common Name

English

Chlorobactene 1

Common Name

English

(all-E)-2-(3,7,12,16,20,24-Hexamethyl-1,3,5,7,9,11,13,15,17,19,23-pentacosaundecaenyl)-1,3,4-trimethylbenzene

Systematic Name

English

Benzene, 2-(3,7,12,16,20,24-hexamethyl-1,3,5,7,9,11,13,15,17,19,23-pentacosaundecaenyl)-1,3,4-trimethyl-, (all-E)-

Systematic Name

English

Code System Code Type Description

CAS

2932-09-4

Created by admin on Tue Apr 01 16:24:59 GMT 2025 , Edited by admin on Tue Apr 01 16:24:59 GMT 2025

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PUBCHEM

10098570

Created by admin on Tue Apr 01 16:24:59 GMT 2025 , Edited by admin on Tue Apr 01 16:24:59 GMT 2025

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EPA CompTox

DTXSID701336837

Created by admin on Tue Apr 01 16:24:59 GMT 2025 , Edited by admin on Tue Apr 01 16:24:59 GMT 2025

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FDA UNII

88JLS9ZM6C

Created by admin on Tue Apr 01 16:24:59 GMT 2025 , Edited by admin on Tue Apr 01 16:24:59 GMT 2025

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