ERGOTAMINE

Test Ligands Values Explained

Test Ligand ID - A unique identifier for the test ligand
Ligand Name - Name of the test ligand

Test Ligand ID797
Ligand NameERGOTAMINE
PubMed Compound Id3251
StructureProduct Image
Molecular FormulaC33H35N5O5
Molecular Weight581.7
SMILESCC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)NC(=O)C5CN(C6CC7=CNC8=CC=CC(=C78)C6=C5)C
SynonymsNSC95090
5'-Benzyl-12'-hydroxy-2'-methyl-3',6',18-trioxoergotaman
Ergotaman-3',6',18-trione, 12'-hydroxy-2'-methyl-5'-(phenylmethyl)-, (5'.alpha.)-
N-(7-benzyl-2-hydroxy-4-methyl-5,8-dioxo-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecan-4-yl)-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide
Ergoton-A [as succinate]
CHEMBL1982133
SCHEMBL18134607
BDBM86529
DTXSID90859201
XCGSFFUVFURLIX-UHFFFAOYSA-N
NSC_3251
CAS_113-15-5
NCI60_042117
XE180555
NS00002283
L000768
5'-Benzyl-12'-hydroxy-2'-methyl-3',6',18-trioxoergotaman #
12'-Hydroxy-2'-methyl-5'.alpha.-(phenylmethyl)ergotaman-3',6',18-trione
(5'.alpha.)-12'-Hydroxy-2'-methyl-5'-(phenylmethyl)ergotoman-3',6',18-trione
Ergotaman-3',18-trione, 12'-hydroxy-2'-methyl-5'-(phenylmethyl)-, (5'.alpha.)-
WLN: T C6656 1A P GN LM CUTT & & J G1 EVM-DT B565 CO EVN HVNTJ BQ D1 G1R
Created AtJan 13, 2025 2:47 pm
Updated AtJan 13, 2025 2:47 pm