1,3,5-TRI-[6-METHYL-8-ALPHA-(DIETHYLCARBAMOYLAMINO)-ERGOLINE-1-YL-METHYL]-2,4,6-TRIMETHYL-BENZENE
Compound with spectra: 1 NMR
![1,3,5-TRI-[6-METHYL-8-ALPHA-(DIETHYLCARBAMOYLAMINO)-ERGOLINE-1-YL-METHYL]-2,4,6-TRIMETHYL-BENZENE](/api/compound/8v1MjdRHiEY.png?ph=true&h=300&w=458 "1,3,5-TRI-[6-METHYL-8-ALPHA-(DIETHYLCARBAMOYLAMINO)-ERGOLINE-1-YL-METHYL]-2,4,6-TRIMETHYL-BENZENE")
| SpectraBase Compound ID | 8v1MjdRHiEY |
|---|---|
| InChI | InChI=1S/C72H96N12O3/c1-13-79(14-2)70(85)73-49-31-55-52-22-19-25-61-67(52)46(28-64(55)76(10)37-49)34-82(61)40-58-43(7)59(41-83-35-47-29-65-56(53-23-20-26-62(83)68(47)53)32-50(38-77(65)11)74-71(86)80(15-3)16-4)45(9)60(44(58)8)42-84-36-48-30-66-57(54-24-21-27-63(84)69(48)54)33-51(39-78(66)12)75-72(87)81(17-5)18-6/h19-27,34-36,49-51,55-57,64-66H,13-18,28-33,37-42H2,1-12H3,(H,73,85)(H,74,86)(H,75,87)/t49-,50-,51-,55+,56+,57+,64+,65+,66+/m0/s1 |
| InChIKey | OOQRPGVFWOOAEC-AFFDKOOGSA-N |
| Mol Weight | 1177.6 g/mol |
| Molecular Formula | C72H96N12O3 |
| Exact Mass | 1176.772835 g/mol |
| Enantiomer InChIKey | OOQRPGVFWOOAEC-NWIFFHEOSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
1,2-DI-[6-METHYL-8-ALPHA-(DIETHYLCARBAMOYLAMINO)-ERGOLINE-1-YL-METHYL]-BENZENE
1,3-DI-[6-METHYL-8-ALPHA-(DIETHYLCARBAMOYLAMINO)-ERGOLINE-1-YL-METHYL]-BENZENE
DI-[6-METHYL-8-ALPHA-(DIETHYLCARBAMOYLAMINO)-ERGOLINE-1-YL]-METHANE
1-CARBOXYMETHYL-6-METHYL-8-ALPHA-(DIETHYLCARBAMOYLAMINO)-ERGOLINE
1,3-DIBROMO-2,2-DI-[6-METHYL-8-ALPHA-(DIETHYLCARBAMOYLAMINO)-ERGOLINE-1-YL-METHYL]-PROPANE
#5C;BROMO-2,2-DI-[6-METHYL-8-ALPHA-(DIETHYLCARBAMOYLAMINO)-ERGOLINE-1-YL-METHYL]-3-[6-METHYL-8-ALPHA-(DIETHYLCARBAMOYLAMINO)-ERGOLINE-1-YL]-PROPANE
Cabergoline artifact (-COOH) METFA
ethyl 4-{5-bromo-2-[(3-fluorobenzyl)oxy]phenyl}-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
JYZNNBUEUCNDIY-UHFFFAOYSA-N
Angustoline
| Title | Journal or Book | Year |
|---|---|---|
| Clustered ergot alkaloids modulate cell-mediated cytotoxicity | Bioorganic & Medicinal Chemistry | 2002 |