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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H16O4
Molecular Weight 272.2958
Optical Activity ( + )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ISOELEUTHERIN, (+)-

SMILES

COC1=CC=CC2=C1C(=O)C3=C(C[C@H](C)O[C@H]3C)C2=O

InChI

InChIKey=IAJIIJBMBCZPSW-IUCAKERBSA-N
InChI=1S/C16H16O4/c1-8-7-11-13(9(2)20-8)16(18)14-10(15(11)17)5-4-6-12(14)19-3/h4-6,8-9H,7H2,1-3H3/t8-,9-/m0/s1

HIDE SMILES / InChI

Molecular Formula C16H16O4
Molecular Weight 272.2958
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 Sat Dec 16 11:49:26 GMT 2023
Edited
by admin
on Sat Dec 16 11:49:26 GMT 2023
Record UNII
059QL9S53Y
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ISOELEUTHERIN, (+)-
Common Name English
(+)-ALLO-ELEUTHERIN
Systematic Name English
1H-NAPHTHO(2,3-C)PYRAN-5,10-DIONE, 3,4-DIHYDRO-9-METHOXY-1,3-DIMETHYL-, (1S,3S)-
Systematic Name English
Code System Code Type Description
CAS
1078723-14-4
Created by admin on Sat Dec 16 11:49:26 GMT 2023 , Edited by admin on Sat Dec 16 11:49:26 GMT 2023
PRIMARY
FDA UNII
059QL9S53Y
Created by admin on Sat Dec 16 11:49:26 GMT 2023 , Edited by admin on Sat Dec 16 11:49:26 GMT 2023
PRIMARY
PUBCHEM
101164912
Created by admin on Sat Dec 16 11:49:26 GMT 2023 , Edited by admin on Sat Dec 16 11:49:26 GMT 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER