.ALPHA.-CAROTENE

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C40H56
Molecular Weight	536.8726
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	9
Charge	0

SHOW SMILES / InChI

Structure of .ALPHA.-CAROTENE

Structure Search

SMILES

CC(\C=C\C=C(C)\C=C\[C@H]1C(C)=CCCC1(C)C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C2=C(C)CCCC2(C)C

InChI

InChIKey=ANVAOWXLWRTKGA-NTXLUARGSA-N

InChI=1S/C40H56/c1-31(19-13-21-33(3)25-27-37-35(5)23-15-29-39(37,7)8)17-11-12-18-32(2)20-14-22-34(4)26-28-38-36(6)24-16-30-40(38,9)10/h11-14,17-23,25-28,37H,15-16,24,29-30H2,1-10H3/b12-11+,19-13+,20-14+,27-25+,28-26+,31-17+,32-18+,33-21+,34-22+/t37-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C40H56
Molecular Weight	536.8726
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	9
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:11:10 UTC 2023` Edited by `admin` on `Fri Dec 15 15:11:10 UTC 2023`
Record UNII	45XWE1Z69V
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

.ALPHA.-CAROTENE

Common Name

English

(ALL-E)-1,3,3-TRIMETHYL-2-(3,7,12,16-TETRAMETHYL-18-(2,6,6-TRIMETHYL-2-CYCLOHEXEN-1-YL)-1,3,5,7,9,11,13,15,17-OCTADECANONAENYL)CYCLOHEXENE

Common Name

English

ALPHA-CAROTENE

Common Name

English

HI-ALPHA

Common Name

English

Alpha-carotene [WHO-DD]

Common Name

English

.ALPHA.-CAROTENE [MI]

Common Name

English

4,5-DIDEHYDRO-5,6-DIHYDRO-.BETA.,.BETA.-CAROTENE

Common Name

English

(6'R)-.BETA.,.EPSILON.-CAROTENE

Common Name

English

C05433

Code

English

1,3,3-TRIMETHYL-2-((1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-TETRAMETHYL-18-(2,6,6-TRIMETHYL-2-CYCLOHEXEN-1-YL)-1,3,5,7,9,11,13,15,17-OCTADECANONAEN-1-YL)CYCLOHEXENE

Systematic Name

English

CHEBI:28425

Code

English

Classification Tree Code System Code

NCI_THESAURUS

C68303

Created by admin on Fri Dec 15 15:11:11 UTC 2023 , Edited by admin on Fri Dec 15 15:11:11 UTC 2023

DSLD

1017 (Number of products:156)

Created by admin on Fri Dec 15 15:11:11 UTC 2023 , Edited by admin on Fri Dec 15 15:11:11 UTC 2023

Code System Code Type Description

CAS

432-70-2

Created by admin on Fri Dec 15 15:11:11 UTC 2023 , Edited by admin on Fri Dec 15 15:11:11 UTC 2023

ALTERNATIVE

MESH

C041635

Created by admin on Fri Dec 15 15:11:11 UTC 2023 , Edited by admin on Fri Dec 15 15:11:11 UTC 2023

PRIMARY

EVMPD

SUB125816

Created by admin on Fri Dec 15 15:11:11 UTC 2023 , Edited by admin on Fri Dec 15 15:11:11 UTC 2023

PRIMARY

WIKIPEDIA

ALPHA-CAROTENE

Created by admin on Fri Dec 15 15:11:11 UTC 2023 , Edited by admin on Fri Dec 15 15:11:11 UTC 2023

PRIMARY

PUBCHEM

6419725

Created by admin on Fri Dec 15 15:11:11 UTC 2023 , Edited by admin on Fri Dec 15 15:11:11 UTC 2023

PRIMARY

CHEBI

28425

Created by admin on Fri Dec 15 15:11:11 UTC 2023 , Edited by admin on Fri Dec 15 15:11:11 UTC 2023

PRIMARY

MERCK INDEX

m3124

Created by admin on Fri Dec 15 15:11:11 UTC 2023 , Edited by admin on Fri Dec 15 15:11:11 UTC 2023

PRIMARY

Merck Index

CAS

7488-99-5

Created by admin on Fri Dec 15 15:11:11 UTC 2023 , Edited by admin on Fri Dec 15 15:11:11 UTC 2023

PRIMARY

FDA UNII

45XWE1Z69V

Created by admin on Fri Dec 15 15:11:11 UTC 2023 , Edited by admin on Fri Dec 15 15:11:11 UTC 2023

PRIMARY

NCI_THESAURUS

C68304

Created by admin on Fri Dec 15 15:11:11 UTC 2023 , Edited by admin on Fri Dec 15 15:11:11 UTC 2023

PRIMARY

SMS_ID

100000151550

Created by admin on Fri Dec 15 15:11:11 UTC 2023 , Edited by admin on Fri Dec 15 15:11:11 UTC 2023

PRIMARY

EPA CompTox

DTXSID00893691

Created by admin on Fri Dec 15 15:11:11 UTC 2023 , Edited by admin on Fri Dec 15 15:11:11 UTC 2023

PRIMARY

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Interaction Type:

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Qualification:

Batch Data

Amount:

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