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Details

Stereochemistry ABSOLUTE
Molecular Formula C17H17ClO6
Molecular Weight 352.766
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ISOGRISEOFULVIN

SMILES

COC1=CC(=O)[C@@]2(OC3=C(C2=O)C(OC)=CC(OC)=C3Cl)[C@H](C)C1

InChI

InChIKey=FFKRWPQQTGWKIH-RBHXEPJQSA-N
InChI=1S/C17H17ClO6/c1-8-5-9(21-2)6-12(19)17(8)16(20)13-10(22-3)7-11(23-4)14(18)15(13)24-17/h6-8H,5H2,1-4H3/t8-,17+/m1/s1

HIDE SMILES / InChI

Molecular Formula C17H17ClO6
Molecular Weight 352.766
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 Mon Mar 31 17:50:29 GMT 2025
Edited
by admin
on Mon Mar 31 17:50:29 GMT 2025
Record UNII
05BMH7SW8M
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ISOGRISEOFULVIN
Common Name English
(+)-ISOGRISEOFULVIN
Preferred Name English
SPIRO(BENZOFURAN-2(3H),1'-(3)CYCLOHEXENE)-2',3-DIONE, 7-CHLORO-4,4',6-TRIMETHOXY-6'-METHYL-, (1'S,6'R)-
Common Name English
SPIRO(BENZOFURAN-2(3H),1'-(3)CYCLOHEXENE)-2',3-DIONE, 7-CHLORO-4,4',6-TRIMETHOXY-6'-METHYL-, (2S-TRANS)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID30963694
Created by admin on Mon Mar 31 17:50:29 GMT 2025 , Edited by admin on Mon Mar 31 17:50:29 GMT 2025
PRIMARY
PUBCHEM
21677661
Created by admin on Mon Mar 31 17:50:29 GMT 2025 , Edited by admin on Mon Mar 31 17:50:29 GMT 2025
PRIMARY
FDA UNII
05BMH7SW8M
Created by admin on Mon Mar 31 17:50:29 GMT 2025 , Edited by admin on Mon Mar 31 17:50:29 GMT 2025
PRIMARY
CAS
469-52-3
Created by admin on Mon Mar 31 17:50:29 GMT 2025 , Edited by admin on Mon Mar 31 17:50:29 GMT 2025
PRIMARY