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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H22N2O3
Molecular Weight 338.4003
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Cyclopiazonic acid, β-

SMILES

CC(C)=CCC1=C2C(C[C@@H]3NC(=O)C(C(C)=O)=C3O)=CNC2=CC=C1

InChI

InChIKey=MVUXMIXDFMUPLL-INIZCTEOSA-N
InChI=1S/C20H22N2O3/c1-11(2)7-8-13-5-4-6-15-18(13)14(10-21-15)9-16-19(24)17(12(3)23)20(25)22-16/h4-7,10,16,21,24H,8-9H2,1-3H3,(H,22,25)/t16-/m0/s1

HIDE SMILES / InChI

Molecular Formula C20H22N2O3
Molecular Weight 338.4003
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 07:05:15 GMT 2023
Edited
by admin
on Sat Dec 16 07:05:15 GMT 2023
Record UNII
CZ7K254JA6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Cyclopiazonic acid, β-
Common Name English
β-Cyclopiazonic acid
Common Name English
Dehydrodisecocyclopiazonic acid
Common Name English
2H-Pyrrol-2-one, 3-acetyl-1,5-dihydro-4-hydroxy-5-[[4-(3-methyl-2-buten-1-yl)-1H-indol-3-yl]methyl]-, (5S)-
Systematic Name English
(3Z,5S)-3-(1-Hydroxyethylidene)-5-[[4-(3-methyl-2-buten-1-yl)-1H-indol-3-yl]methyl]-2,4-pyrrolidinedione
Systematic Name English
2,4-Pyrrolidinedione, 3-(1-hydroxyethylidene)-5-[[4-(3-methyl-2-butenyl)-1H-indol-3-yl]methyl]-, (3Z,5S)-
Systematic Name English
Disecocyclopiazonic acid, dehydro-
Common Name English
(5S)-3-Acetyl-1,5-dihydro-4-hydroxy-5-[[4-(3-methyl-2-buten-1-yl)-1H-indol-3-yl]methyl]-2H-pyrrol-2-one
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID90184989
Created by admin on Sat Dec 16 07:05:15 GMT 2023 , Edited by admin on Sat Dec 16 07:05:15 GMT 2023
PRIMARY
CAS
142287-59-0
Created by admin on Sat Dec 16 07:05:15 GMT 2023 , Edited by admin on Sat Dec 16 07:05:15 GMT 2023
ALTERNATIVE
CAS
31008-70-5
Created by admin on Sat Dec 16 07:05:15 GMT 2023 , Edited by admin on Sat Dec 16 07:05:15 GMT 2023
PRIMARY
PUBCHEM
54675760
Created by admin on Sat Dec 16 07:05:15 GMT 2023 , Edited by admin on Sat Dec 16 07:05:15 GMT 2023
PRIMARY
FDA UNII
CZ7K254JA6
Created by admin on Sat Dec 16 07:05:15 GMT 2023 , Edited by admin on Sat Dec 16 07:05:15 GMT 2023
PRIMARY