2,2'-METHYLENEBIS(3,6-DIHYDROXY-5-TRIDECYL-2,5-CYCLOHEXADIENE-1,4-DIONE)

Details

Stereochemistry	ACHIRAL
Molecular Formula	C39H60O8
Molecular Weight	656.8889
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2,2'-METHYLENEBIS(3,6-DIHYDROXY-5-TRIDECYL-2,5-CYCLOHEXADIENE-1,4-DIONE)

Structure Search

SMILES

CCCCCCCCCCCCCC1=C(O)C(=O)C(CC2=C(O)C(=O)C(CCCCCCCCCCCCC)=C(O)C2=O)=C(O)C1=O

InChI

InChIKey=UJRBGYWAIIVDNE-UHFFFAOYSA-N

InChI=1S/C39H60O8/c1-3-5-7-9-11-13-15-17-19-21-23-25-28-32(40)36(44)30(37(45)33(28)41)27-31-38(46)34(42)29(35(43)39(31)47)26-24-22-20-18-16-14-12-10-8-6-4-2/h40,42,45,47H,3-27H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C39H60O8
Molecular Weight	656.8889
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 19:33:52 GMT 2025` Edited by `admin` on `Tue Apr 01 19:33:52 GMT 2025`
Record UNII	MRU4UWP81Z
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2,2'-METHYLENEBIS(3,6-DIHYDROXY-5-TRIDECYL-2,5-CYCLOHEXADIENE-1,4-DIONE)

Systematic Name

English

NSC-88927

Preferred Name

English

2,5-CYCLOHEXADIENE-1,4-DIONE, 2,2'-METHYLENEBIS(3,6-DIHYDROXY-5-TRIDECYL-

Systematic Name

English

P-BENZOQUINONE, 2,2'-METHYLENEBIS(3,6-DIHYDROXY-5-TRIDECYL-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID00160951