**This is a beta version of MetaNetX/MNXref, MNXref identifiers may not be final**

3-(4-methylpent-3-en-1-yl)-pent-2-enedioyl-CoA

Properties Image Occurences in reactions MNX_ID MNXM1378635 #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 0 formula C32H45N7O19P3S charge -5 mass 956.721 reference metacycM:CPD-76 InChIKey BVEJAKPMABGOEE-UYRXBGFRSA-I InChI InChI=1S/C32H50N7O19P3S/c1-18(2)6-5-7-19(12-22(41)42)13-23(43)62-11-10-34-21(40)8-9-35-30(46)27(45)32(3,4)15-55-61(52,53)58-60(50,51)54-14-20-26(57-59(47,48)49)25(44)31(56-20)39-17-38-24-28(33)36-16-37-29(24)39/h6,13,16-17,20,25-27,31,44-45H,5,7-12,14-15H2,1-4H3,(H,34,40)(H,35,46)(H,41,42)(H,50,51)(H,52,53)(H2,33,36,37)(H2,47,48,49)/p-5/b19-13- SMILES [CH3:1][C:18]([CH3:2])=[CH:6][CH2:5][CH2:7]/[C:19]([CH2:12][C:22](=[O:41])[OH:42])=[CH:13]/[C:23](=[O:43])[S:62][CH2:11][CH2:10][N:34]=[C:21]([CH2:8][CH2:9][N:35]=[C:30]([CH:27]([C:32]([CH3:3])([CH3:4])[CH2:15][O:55][P:61]([OH:52])(=[O:53])[O:58][P:60]([OH:50])(=[O:51])[O:54][CH2:14][CH:20]1[CH:26]([O:57][P:59]([OH:47])([OH:48])=[O:49])[CH:25]([OH:44])[CH:31]([n:39]2[cH:17][n:38][c:24]3[c:28]([NH2:33])[n:36][cH:16][n:37][c:29]32)[O:56]1)[OH:45])[OH:46])[OH:40]

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Similar chemical compounds in external resources

Identifier	Description
metacyc.compound:CPD-76 metacycM:CPD-76	3-(4-methylpent-3-en-1-yl)-pent-2-enedioyl-CoA isohexenyl-glutaconyl-CoA