(2RS)-7,8-DIMETHOXY-2,5-DIMETHYL-2-((ALL-E)-4,8,12,16,20,24,28,32,36-NONAMETHYLHEPTATRIACONTA-3,7,11,15,19,23,27,31,35-NONAENYL)-2H-1-BENZOPYRAN-6-OL

Details

Stereochemistry	RACEMIC
Molecular Formula	C59H90O4
Molecular Weight	863.3435
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	8
Charge	0

SHOW SMILES / InChI

Structure of (2RS)-7,8-DIMETHOXY-2,5-DIMETHYL-2-((ALL-E)-4,8,12,16,20,24,28,32,36-NONAMETHYLHEPTATRIACONTA-3,7,11,15,19,23,27,31,35-NONAENYL)-2H-1-BENZOPYRAN-6-OL

Structure Search

SMILES

COC1=C(O)C(C)=C2C=CC(C)(CC\C=C(/C)CC\C=C(/C)CC\C=C(/C)CC\C=C(/C)CC\C=C(/C)CC\C=C(/C)CC\C=C(/C)CC\C=C(/C)CCC=C(C)C)OC2=C1OC

InChI

InChIKey=ARZCDYVIZADZJN-UOLLGXFBSA-N

InChI=1S/C59H90O4/c1-44(2)24-15-25-45(3)26-16-27-46(4)28-17-29-47(5)30-18-31-48(6)32-19-33-49(7)34-20-35-50(8)36-21-37-51(9)38-22-39-52(10)40-23-42-59(12)43-41-54-53(11)55(60)57(61-13)58(62-14)56(54)63-59/h24,26,28,30,32,34,36,38,40-41,43,60H,15-23,25,27,29,31,33,35,37,39,42H2,1-14H3/b45-26+,46-28+,47-30+,48-32+,49-34+,50-36+,51-38+,52-40+

HIDE SMILES / InChI

Molecular Formula	C59H90O4
Molecular Weight	863.3435
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	8
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 15:10:50 GMT 2023` Edited by `admin` on `Sat Dec 16 15:10:50 GMT 2023`
Record UNII	AM9UDL3AFP
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(2RS)-7,8-DIMETHOXY-2,5-DIMETHYL-2-((ALL-E)-4,8,12,16,20,24,28,32,36-NONAMETHYLHEPTATRIACONTA-3,7,11,15,19,23,27,31,35-NONAENYL)-2H-1-BENZOPYRAN-6-OL

Systematic Name

English

UBICROMENOL [EP IMPURITY]

Common Name

English

2H-1-BENZOPYRAN-6-OL, 7,8-DIMETHOXY-2,5-DIMETHYL-2-(4,8,12,16,20,24,28,32,36-NONAMETHYL-3,7,11,15,19,23,27,31,35-HEPTATRIACONTANONAENYL)-, (ALL-E)-

Systematic Name

English

UBIDECARENONE IMPURITY E [EP IMPURITY]

Common Name

English

Code System Code Type Description

CAS

65085-30-5

Created by admin on Sat Dec 16 15:10:50 GMT 2023 , Edited by admin on Sat Dec 16 15:10:50 GMT 2023

PRIMARY

PUBCHEM

10485771

Created by admin on Sat Dec 16 15:10:50 GMT 2023 , Edited by admin on Sat Dec 16 15:10:50 GMT 2023

PRIMARY

FDA UNII

AM9UDL3AFP

Created by admin on Sat Dec 16 15:10:50 GMT 2023 , Edited by admin on Sat Dec 16 15:10:50 GMT 2023

PRIMARY

Related Record Type Details


					EJ27X76M46

UBIDECARENONE

PARENT -> IMPURITY

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

EP

Amount: