.ALPHA.-CYANO-9,10-DIDEHYDRO-6-METHYL-ERGOLINE-8-PROPANAMIDE, (8.BETA.)-

Details

Stereochemistry	EPIMERIC
Molecular Formula	C19H20N4O
Molecular Weight	320.3883
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of .ALPHA.-CYANO-9,10-DIDEHYDRO-6-METHYL-ERGOLINE-8-PROPANAMIDE, (8.BETA.)-

Structure Search

SMILES

[H][C@@]12CC3=CNC4=CC=CC(=C34)C1=C[C@@H](CC(C#N)C(N)=O)CN2C

InChI

InChIKey=KIGWLQJAJQIKNY-PLCQNAAUSA-N

InChI=1S/C19H20N4O/c1-23-10-11(5-12(8-20)19(21)24)6-15-14-3-2-4-16-18(14)13(9-22-16)7-17(15)23/h2-4,6,9,11-12,17,22H,5,7,10H2,1H3,(H2,21,24)/t11-,12?,17-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C19H20N4O
Molecular Weight	320.3883
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	2 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:28:46 GMT 2023` Edited by `admin` on `Sat Dec 16 08:28:46 GMT 2023`
Record UNII	33E77G1P59
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

.ALPHA.-CYANO-9,10-DIDEHYDRO-6-METHYL-ERGOLINE-8-PROPANAMIDE, (8.BETA.)-

Systematic Name

English

ERGOLINE-8-PROPIONAMIDE, 9,10-DIDEHYDRO-ALPHA-CYANO-6-METHYL-, (8-BETA)-

Systematic Name

English

ERGOLINE-8-PROPANAMIDE, .ALPHA.-CYANO-9,10-DIDEHYDRO-6-METHYL-, (8.BETA.)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

56843556

Created by admin on Sat Dec 16 08:28:46 GMT 2023 , Edited by admin on Sat Dec 16 08:28:46 GMT 2023

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EPA CompTox

DTXSID901007955

Created by admin on Sat Dec 16 08:28:46 GMT 2023 , Edited by admin on Sat Dec 16 08:28:46 GMT 2023

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FDA UNII

33E77G1P59

Created by admin on Sat Dec 16 08:28:46 GMT 2023 , Edited by admin on Sat Dec 16 08:28:46 GMT 2023

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CAS

88133-19-1

Created by admin on Sat Dec 16 08:28:46 GMT 2023 , Edited by admin on Sat Dec 16 08:28:46 GMT 2023

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