N8-(3-(DIMETHYLAMINO)PROPYL)-N1-ETHYL-6-(2-PROPENYL)-ERGOLINE-1,8-DICARBOXAMIDE, (8.BETA.)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C26H37N5O2
Molecular Weight	451.6043
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of N8-(3-(DIMETHYLAMINO)PROPYL)-N1-ETHYL-6-(2-PROPENYL)-ERGOLINE-1,8-DICARBOXAMIDE, (8.BETA.)-

Structure Search

SMILES

CCNC(=O)N1C=C2C[C@@H]3[C@H](C[C@H](CN3CC=C)C(=O)NCCCN(C)C)C4=CC=CC1=C24

InChI

InChIKey=IRQIOIBAVPLXLF-KJXAQDMKSA-N

InChI=1S/C26H37N5O2/c1-5-12-30-16-19(25(32)28-11-8-13-29(3)4)14-21-20-9-7-10-22-24(20)18(15-23(21)30)17-31(22)26(33)27-6-2/h5,7,9-10,17,19,21,23H,1,6,8,11-16H2,2-4H3,(H,27,33)(H,28,32)/t19-,21-,23-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C26H37N5O2
Molecular Weight	451.6043
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:20:20 GMT 2025` Edited by `admin` on `Mon Mar 31 21:20:20 GMT 2025`
Record UNII	3LCV6MB85B
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CABERGOLINE IMPURITY B [EP IMPURITY]

Preferred Name

English

N8-(3-(DIMETHYLAMINO)PROPYL)-N1-ETHYL-6-(2-PROPENYL)-ERGOLINE-1,8-DICARBOXAMIDE, (8.BETA.)-

Systematic Name

English

CABERGOLINE RELATED COMPOUND B [USP IMPURITY]

Common Name

English

(6AR,9R,10AR)-N9-(3-(DIMETHYLAMINO)PROPYL)-N4-ETHYL-7-(PROP-2-ENYL)6A,7,8,9,10,10A-HEXAHYDROINDOLO(4,3-FG)QUINOLINE-4,9(6H)-DICARBOXAMIDE

Common Name

English

ERGOLINE-1,8-DICARBOXAMIDE, N8-(3-(DIMETHYLAMINO)PROPYL)-N1-ETHYL-6-(2-PROPENYL)-, (8.BETA.)-

Systematic Name

English

Code System Code Type Description

CAS

166533-36-4

Created by admin on Mon Mar 31 21:20:20 GMT 2025 , Edited by admin on Mon Mar 31 21:20:20 GMT 2025

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FDA UNII

3LCV6MB85B

Created by admin on Mon Mar 31 21:20:20 GMT 2025 , Edited by admin on Mon Mar 31 21:20:20 GMT 2025

PRIMARY

EPA CompTox

DTXSID00168119

Created by admin on Mon Mar 31 21:20:20 GMT 2025 , Edited by admin on Mon Mar 31 21:20:20 GMT 2025

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PUBCHEM

71587562

Created by admin on Mon Mar 31 21:20:20 GMT 2025 , Edited by admin on Mon Mar 31 21:20:20 GMT 2025

PRIMARY

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