| SpectraBase Spectrum ID |
9GE3fQq0MYi |
| Name |
1,3,5-TRI-[6-METHYL-8-ALPHA-(DIETHYLCARBAMOYLAMINO)-ERGOLINE-1-YL-METHYL]-2,4,6-TRIMETHYL-BENZENE |
| Compound Number |
6 |
| Copyright |
Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula |
C72H96N12O3 |
| 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 |
| Literature Reference Author |
V.KREN,A.FISEROVA,L.WEIGNEROVA,I.STIBOR,P.HALADA,V.PRIKRYLOV
A,P.SEDMERA,M.POSPIS |
| Literature Reference Citation |
BIOORG.MED.CHEM.,10,415(2002) |
| Literature Reference DOI |
10.1016/S0968-0896(01)00291-7 |
| Molecular Weight |
1177.633 g/mol |
| Solvent |
CDCl3 |
| Source File Reference |
UWLU30929 |
![1,3,5-TRI-[6-METHYL-8-ALPHA-(DIETHYLCARBAMOYLAMINO)-ERGOLINE-1-YL-METHYL]-2,4,6-TRIMETHYL-BENZENE](/api/spectrum/9GE3fQq0MYi/structure.png?h=300&w=458 "1,3,5-TRI-[6-METHYL-8-ALPHA-(DIETHYLCARBAMOYLAMINO)-ERGOLINE-1-YL-METHYL]-2,4,6-TRIMETHYL-BENZENE")
