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Details

Stereochemistry ABSOLUTE
Molecular Formula C14H26O6
Molecular Weight 290.3526
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of RO-61-0591

SMILES

CCCCCC[C@@H]([C@H](O)C[C@@H](O)CCC(O)=O)C(O)=O

InChI

InChIKey=XXJYVIMIEJMJBD-SDDRHHMPSA-N
InChI=1S/C14H26O6/c1-2-3-4-5-6-11(14(19)20)12(16)9-10(15)7-8-13(17)18/h10-12,15-16H,2-9H2,1H3,(H,17,18)(H,19,20)/t10-,11-,12+/m0/s1

HIDE SMILES / InChI

Molecular Formula C14H26O6
Molecular Weight 290.3526
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:33:59 GMT 2023
Edited
by admin
on Sat Dec 16 09:33:59 GMT 2023
Record UNII
Y69ULD0NKC
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
RO-61-0591
Common Name English
OCTANEDIOIC ACID, 2-HEXYL-3,5-DIHYDROXY-, (2S,3R,5S)-
Systematic Name English
ORLISTAT (M9)
Common Name English
RO 61-0591
Systematic Name English
Code System Code Type Description
FDA UNII
Y69ULD0NKC
Created by admin on Sat Dec 16 09:33:59 GMT 2023 , Edited by admin on Sat Dec 16 09:33:59 GMT 2023
PRIMARY
PUBCHEM
91800201
Created by admin on Sat Dec 16 09:33:59 GMT 2023 , Edited by admin on Sat Dec 16 09:33:59 GMT 2023
PRIMARY
CAS
186423-00-7
Created by admin on Sat Dec 16 09:33:59 GMT 2023 , Edited by admin on Sat Dec 16 09:33:59 GMT 2023
NON-SPECIFIC STEREOCHEMISTRY