SESAMIN

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H18O6
Molecular Weight	354.3533
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of SESAMIN

Structure Search

SMILES

[H][C@]12CO[C@H](C3=CC4=C(OCO4)C=C3)[C@@]1([H])CO[C@@H]2C5=CC6=C(OCO6)C=C5

InChI

InChIKey=PEYUIKBAABKQKQ-AFHBHXEDSA-N

InChI=1S/C20H18O6/c1-3-15-17(25-9-23-15)5-11(1)19-13-7-22-20(14(13)8-21-19)12-2-4-16-18(6-12)26-10-24-16/h1-6,13-14,19-20H,7-10H2/t13-,14-,19+,20+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C20H18O6
Molecular Weight	354.3533
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 `Fri Dec 15 20:39:39 UTC 2023` Edited by `admin` on `Fri Dec 15 20:39:39 UTC 2023`
Record UNII	S7946O4P76
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SESAMIN

Common Name

English

FAGAROL

Common Name

English

Sesamin [WHO-DD]

Common Name

English

D-(+)-SESAMIN

Common Name

English

D-SESAMIN

Common Name

English

5,5'-(TETRAHYDRO-1H,3H-FURO(3,4-C)FURAN-1,4-DIYL)BIS-1,3-BENZODIOXOLE

Systematic Name

English

1,3-BENZODIOXOLE, 5,5'-(TETRAHYDRO-1H,3H-FURO(3,4-C)FURAN-1,4-DIYL)BIS-, (1S-(1.ALPHA.,3A .ALPHA.,4.ALPHA.,6A .ALPHA.))-

Common Name

English

SEZAMIN

Common Name

English

(+)-SESAMIN

Common Name

English

SESAMIN, (+)-

Common Name

English

SESAMIN D-FORM [MI]

Common Name

English

1H,3H-FURO(3,4-C)FURAN, TETRAHYDRO-1,4-BIS(3,4-(METHYLENEDIOXY)PHENYL)-, (1S,3AR,4S,6AR)-

Common Name

English

TETRAHYDRO-1,4-BIS(3,4-(METHYLENEDIOXY)PHENYL)-1H,3H-FURO(3,4-C)FURAN

Systematic Name

English

NSC-36403

Code

English

SESAMIN [MI]

Common Name

English

Classification Tree Code System Code

EPA PESTICIDE CODE

298400

Created by admin on Fri Dec 15 20:39:39 UTC 2023 , Edited by admin on Fri Dec 15 20:39:39 UTC 2023

Code System Code Type Description

PUBCHEM

72307

Created by admin on Fri Dec 15 20:39:39 UTC 2023 , Edited by admin on Fri Dec 15 20:39:39 UTC 2023

PRIMARY

DAILYMED

S7946O4P76

Created by admin on Fri Dec 15 20:39:39 UTC 2023 , Edited by admin on Fri Dec 15 20:39:39 UTC 2023

PRIMARY

RXCUI

2593413

Created by admin on Fri Dec 15 20:39:39 UTC 2023 , Edited by admin on Fri Dec 15 20:39:39 UTC 2023

PRIMARY

CAS

7076-24-6

Created by admin on Fri Dec 15 20:39:39 UTC 2023 , Edited by admin on Fri Dec 15 20:39:39 UTC 2023

NON-SPECIFIC STEREOCHEMISTRY

MESH

C054125

Created by admin on Fri Dec 15 20:39:39 UTC 2023 , Edited by admin on Fri Dec 15 20:39:39 UTC 2023

PRIMARY

WIKIPEDIA

SESAMIN

Created by admin on Fri Dec 15 20:39:39 UTC 2023 , Edited by admin on Fri Dec 15 20:39:39 UTC 2023

PRIMARY

EVMPD

SUB120775

Created by admin on Fri Dec 15 20:39:39 UTC 2023 , Edited by admin on Fri Dec 15 20:39:39 UTC 2023

PRIMARY

SMS_ID

100000144024

Created by admin on Fri Dec 15 20:39:39 UTC 2023 , Edited by admin on Fri Dec 15 20:39:39 UTC 2023

PRIMARY

CAS

607-80-7

Created by admin on Fri Dec 15 20:39:39 UTC 2023 , Edited by admin on Fri Dec 15 20:39:39 UTC 2023

PRIMARY

MERCK INDEX

m9879

Created by admin on Fri Dec 15 20:39:39 UTC 2023 , Edited by admin on Fri Dec 15 20:39:39 UTC 2023

PRIMARY

Merck Index

MERCK INDEX

m9879

Created by admin on Fri Dec 15 20:39:39 UTC 2023 , Edited by admin on Fri Dec 15 20:39:39 UTC 2023

PRIMARY

Merck Index

NSC

36403

Created by admin on Fri Dec 15 20:39:39 UTC 2023 , Edited by admin on Fri Dec 15 20:39:39 UTC 2023

PRIMARY

EPA CompTox

DTXSID301030528

Created by admin on Fri Dec 15 20:39:39 UTC 2023 , Edited by admin on Fri Dec 15 20:39:39 UTC 2023

PRIMARY

CHEBI

66470

Created by admin on Fri Dec 15 20:39:39 UTC 2023 , Edited by admin on Fri Dec 15 20:39:39 UTC 2023

PRIMARY

FDA UNII

S7946O4P76

Created by admin on Fri Dec 15 20:39:39 UTC 2023 , Edited by admin on Fri Dec 15 20:39:39 UTC 2023

PRIMARY

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Related Record Type Details


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SESAMIN MONOCATECHOL 3-GLUCORONIDE

METABOLITE -> PARENT


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SESAMIN MONOCATECHOL 4-METHYLATE

METABOLITE -> PARENT


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SESAMIN MONOCATECHOL 4-GLUCORONIDE

METABOLITE -> PARENT


					Y5Y6335JEF

SESAMIN DICATECHOL

METABOLITE -> PARENT


					CLA6B4LBF3

SESAMIN MONOCATECHOL 3-METHYLATE

METABOLITE -> PARENT


					F8YB79JA5A

SESAMIN MONOCATECHOL

METABOLITE -> PARENT