DEOXYFRENOLICIN

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NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C18H18O6
Molecular Weight	330.3319
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of DEOXYFRENOLICIN

Structure Search

SMILES

CCC[C@H]1O[C@H](CC(O)=O)CC2=C1C(=O)C3=C(O)C=CC=C3C2=O

InChI

InChIKey=XWXZEYLPRXYHQC-TVQRCGJNSA-N

InChI=1S/C18H18O6/c1-2-4-13-16-11(7-9(24-13)8-14(20)21)17(22)10-5-3-6-12(19)15(10)18(16)23/h3,5-6,9,13,19H,2,4,7-8H2,1H3,(H,20,21)/t9-,13+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C18H18O6
Molecular Weight	330.3319
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 20:56:10 GMT 2025` Edited by `admin` on `Mon Mar 31 20:56:10 GMT 2025`
Record UNII	L0RG5J840S
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DEOXYFRENOLICIN

Preferred Name

English

Code System Code Type Description

FDA UNII

L0RG5J840S

Created by admin on Mon Mar 31 20:56:10 GMT 2025 , Edited by admin on Mon Mar 31 20:56:10 GMT 2025

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MESH

C004673

Created by admin on Mon Mar 31 20:56:10 GMT 2025 , Edited by admin on Mon Mar 31 20:56:10 GMT 2025

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EPA CompTox

DTXSID90143036

Created by admin on Mon Mar 31 20:56:10 GMT 2025 , Edited by admin on Mon Mar 31 20:56:10 GMT 2025

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CAS

10023-11-7

Created by admin on Mon Mar 31 20:56:10 GMT 2025 , Edited by admin on Mon Mar 31 20:56:10 GMT 2025

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PUBCHEM

3084051

Created by admin on Mon Mar 31 20:56:10 GMT 2025 , Edited by admin on Mon Mar 31 20:56:10 GMT 2025

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