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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H15ClO6
Molecular Weight 338.74
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of GRISEOFULVIC ACID

SMILES

COC1=CC(OC)=C2C(=O)[C@]3(OC2=C1Cl)[C@H](C)CC(=O)CC3=O

InChI

InChIKey=YIQRSAKVWZVLDN-QZTNRIJFSA-N
InChI=1S/C16H15ClO6/c1-7-4-8(18)5-11(19)16(7)15(20)12-9(21-2)6-10(22-3)13(17)14(12)23-16/h6-7H,4-5H2,1-3H3/t7-,16+/m1/s1

HIDE SMILES / InChI

Molecular Formula C16H15ClO6
Molecular Weight 338.74
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 18:57:50 UTC 2023
Edited
by admin
on Sat Dec 16 18:57:50 UTC 2023
Record UNII
DMG8UC5TE5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
GRISEOFULVIC ACID
Common Name English
(1'S,6'R)-7-CHLORO-4,6-DIMETHOXY-6'-METHYLSPIRO(BENZOFURAN-2(3H),1'-CYCLOHEXANE)-2',3,4'-TRIONE
Systematic Name English
SPIRO(BENZOFURAN-2(3H),1'-CYCLOHEXANE)-2',3,4'-TRIONE, 7-CHLORO-4,6-DIMETHOXY-6'-METHYL-, (1'S,6'R)-
Systematic Name English
SPIRO(BENZOFURAN-2(3H),1'-CYCLOHEXANE)-2',3,4'-TRIONE, 7-CHLORO-4,6-DIMETHOXY-6'-METHYL-, TRANS-
Common Name English
GRISEOFULVIN IMPURITY A [EP IMPURITY]
Common Name English
(1'S,6'R)-7-CHLORO-4,6-DIMETHOXY-6'-METHYL-3H-SPIRO(1-BENZOFURAN-2,1'-CYCLOHEXANE)-2',3,4'-TRIONE
Systematic Name English
Code System Code Type Description
PUBCHEM
71317160
Created by admin on Sat Dec 16 18:57:50 UTC 2023 , Edited by admin on Sat Dec 16 18:57:50 UTC 2023
PRIMARY
FDA UNII
DMG8UC5TE5
Created by admin on Sat Dec 16 18:57:50 UTC 2023 , Edited by admin on Sat Dec 16 18:57:50 UTC 2023
PRIMARY
CAS
469-54-5
Created by admin on Sat Dec 16 18:57:50 UTC 2023 , Edited by admin on Sat Dec 16 18:57:50 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP