Sesaminol, (+)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H18O7
Molecular Weight	370.3527
Optical Activity	( + )
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]12CO[C@H](C3=C(O)C=C4OCOC4=C3)[C@@]1([H])CO[C@@H]2C5=CC6=C(OCO6)C=C5

InChI

InChIKey=KQRXQIPRDKVZPW-ISZNXKAUSA-N

InChI=1S/C20H18O7/c21-14-5-18-17(26-9-27-18)4-11(14)20-13-7-22-19(12(13)6-23-20)10-1-2-15-16(3-10)25-8-24-15/h1-5,12-13,19-21H,6-9H2/t12-,13-,19+,20+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C20H18O7
Molecular Weight	370.3527
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 `Sat Dec 16 10:07:23 GMT 2023` Edited by `admin` on `Sat Dec 16 10:07:23 GMT 2023`
Record UNII	QTS6XJP5LC
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Sesaminol, (+)-

Common Name

English

6-[(1S,3aR,4S,6aR)-4-(1,3-Benzodioxol-5-yl)tetrahydro-1H,3H-furo[3,4-c]furan-1-yl]-1,3-benzodioxol-5-ol

Systematic Name

English

Sesaminol

Official Name

English

1,3-Benzodioxol-5-ol, 6-[(1S,3aR,4S,6aR)-4-(1,3-benzodioxol-5-yl)tetrahydro-1H,3H-furo[3,4-c]furan-1-yl]-

Systematic Name

English

(+)-Sesaminol

Common Name

English

Code System Code Type Description

PUBCHEM

94672

Created by admin on Sat Dec 16 10:07:23 GMT 2023 , Edited by admin on Sat Dec 16 10:07:23 GMT 2023

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CAS

74061-79-3

Created by admin on Sat Dec 16 10:07:23 GMT 2023 , Edited by admin on Sat Dec 16 10:07:23 GMT 2023

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FDA UNII

QTS6XJP5LC

Created by admin on Sat Dec 16 10:07:23 GMT 2023 , Edited by admin on Sat Dec 16 10:07:23 GMT 2023

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EPA CompTox

DTXSID50995513

Created by admin on Sat Dec 16 10:07:23 GMT 2023 , Edited by admin on Sat Dec 16 10:07:23 GMT 2023

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