U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C17H21N3O
Molecular Weight 283.3681
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-METHYLERGOLINE-8-ACETAMIDE, (8-.BETA.)-

SMILES

[H][C@@]12CC3=CNC4=C3C(=CC=C4)[C@@]1([H])C[C@@H](CC(N)=O)CN2C

InChI

InChIKey=CHCGOOUKGROCOZ-PSOPSSQASA-N
InChI=1S/C17H21N3O/c1-20-9-10(6-16(18)21)5-13-12-3-2-4-14-17(12)11(8-19-14)7-15(13)20/h2-4,8,10,13,15,19H,5-7,9H2,1H3,(H2,18,21)/t10-,13+,15+/m0/s1

HIDE SMILES / InChI

Molecular Formula C17H21N3O
Molecular Weight 283.3681
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 Sat Dec 16 02:06:21 GMT 2023
Edited
by admin
on Sat Dec 16 02:06:21 GMT 2023
Record UNII
D7HH5OGW9W
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6-METHYLERGOLINE-8-ACETAMIDE, (8-.BETA.)-
Common Name English
6-METHYLERGOLINE-8.BETA.-ACETAMIDE
Systematic Name English
ERGOLINE-8-ACETAMIDE, 6-METHYL-, (8.BETA.)-
Systematic Name English
J389.146A
Code English
2-((8.BETA.,10.XI.)-6-METHYLERGOLIN-8-YL)ACETAMIDE
Systematic Name English
(8-.BETA.)-6-METHYLERGOLINE-8-ACETAMIDE
Common Name English
D-8.BETA.-(CARBAMOYLMETHYL)-6-METHYLERGOLINE
Common Name English
.ALPHA.-D-6-METHYLERGOLINYL-8-ACETAMIDE
Common Name English
ACETAMIDE, 2-((8.BETA.,10.XI.)-6-METHYLERGOLIN-8-YL)-
Systematic Name English
2-((6AR,9S)-7-METHYL-6,6A,8,9,10,10A-HEXAHYDRO-4H-INDOLO(4,3-FG)QUINOLINE-9-YL)ACETAMIDE
Systematic Name English
D-6-METHYLERGOLIN-8-YLACETAMIDE
Common Name English
ERGOLINE-8.BETA.-ACETAMIDE, 6-METHYL-
Systematic Name English
Code System Code Type Description
CAS
33529-63-4
Created by admin on Sat Dec 16 02:06:22 GMT 2023 , Edited by admin on Sat Dec 16 02:06:22 GMT 2023
PRIMARY
FDA UNII
D7HH5OGW9W
Created by admin on Sat Dec 16 02:06:22 GMT 2023 , Edited by admin on Sat Dec 16 02:06:22 GMT 2023
PRIMARY
PUBCHEM
21124022
Created by admin on Sat Dec 16 02:06:22 GMT 2023 , Edited by admin on Sat Dec 16 02:06:22 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
Related Record Type Details
ACTIVE MOIETY