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Details

Stereochemistry ACHIRAL
Molecular Formula C12H16O3
Molecular Weight 208.2536
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of ISOELEMICIN

SMILES

COC1=CC(\C=C\C)=CC(OC)=C1OC

InChI

InChIKey=RRXOQHQFJOQLQR-AATRIKPKSA-N
InChI=1S/C12H16O3/c1-5-6-9-7-10(13-2)12(15-4)11(8-9)14-3/h5-8H,1-4H3/b6-5+

HIDE SMILES / InChI

Molecular Formula C12H16O3
Molecular Weight 208.2536
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 19:49:48 GMT 2023
Edited
by admin
on Fri Dec 15 19:49:48 GMT 2023
Record UNII
9260LA114I
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ISOELEMICIN
Systematic Name English
BENZENE, 1,2,3-TRIMETHOXY-5-(1E)-1-PROPEN-1-YL-
Systematic Name English
ISOELEMICIN, TRANS-
Systematic Name English
ISOELEMICIN, (E)-
Systematic Name English
1,2,3-TRIMETHOXY-5-((1E)-1-PROPENYL)BENZENE
Systematic Name English
(E)-ISOELEMICIN
Systematic Name English
Code System Code Type Description
PUBCHEM
5318557
Created by admin on Fri Dec 15 19:49:48 GMT 2023 , Edited by admin on Fri Dec 15 19:49:48 GMT 2023
PRIMARY
EPA CompTox
DTXSID80101754
Created by admin on Fri Dec 15 19:49:48 GMT 2023 , Edited by admin on Fri Dec 15 19:49:48 GMT 2023
PRIMARY
CAS
5273-85-8
Created by admin on Fri Dec 15 19:49:48 GMT 2023 , Edited by admin on Fri Dec 15 19:49:48 GMT 2023
PRIMARY
FDA UNII
9260LA114I
Created by admin on Fri Dec 15 19:49:48 GMT 2023 , Edited by admin on Fri Dec 15 19:49:48 GMT 2023
PRIMARY