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(3R)-3-hydroxydodecanoyl-CoA

Properties Image Occurences in reactions MNX_ID MNXM1364833 #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 2 formula C33H54N7O18P3S charge -4 mass 961.805 reference chebi:74276 InChIKey IJFLXRCJWPKGKJ-IGYWURMESA-J InChI InChI=1S/C33H58N7O18P3S/c1-4-5-6-7-8-9-10-11-21(41)16-24(43)62-15-14-35-23(42)12-13-36-31(46)28(45)33(2,3)18-55-61(52,53)58-60(50,51)54-17-22-27(57-59(47,48)49)26(44)32(56-22)40-20-39-25-29(34)37-19-38-30(25)40/h19-22,26-28,32,41,44-45H,4-18H2,1-3H3,(H,35,42)(H,36,46)(H,50,51)(H,52,53)(H2,34,37,38)(H2,47,48,49)/p-4/t21-,22-,26-,27-,28+,32-/m1/s1 SMILES [CH3:1][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][C@H:21]([CH2:16][C:24](=[O:43])[S:62][CH2:15][CH2:14][N:35]=[C:23]([CH2:12][CH2:13][N:36]=[C:31]([C@@H:28]([C:33]([CH3:2])([CH3:3])[CH2:18][O:55][P:61]([OH:52])(=[O:53])[O:58][P:60]([OH:50])(=[O:51])[O:54][CH2:17][C@@H:22]1[C@@H:27]([O:57][P:59]([OH:47])([OH:48])=[O:49])[C@@H:26]([OH:44])[C@H:32]([n:40]2[cH:20][n:39][c:25]3[c:29]([NH2:34])[n:37][cH:19][n:38][c:30]32)[O:56]1)[OH:45])[OH:46])[OH:42])[OH:41]

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Similar chemical compounds in external resources

Identifier	Description
CHEBI:74276 chebi:74276	(3R)-3-hydroxydodecanoyl-CoA (R)-3-hydroxydodecanoyl-CoA(4-) (R)-3-hydroxydodecanoyl-coenzyme A(4-) (R)-3-hydroxylauroyl-CoA (R)-3-hydroxylauroyl-CoA(4-) (R)-3-hydroxylauroyl-coenzyme A(4-) 3'-phosphonatoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3R)-3-hydroxydodecanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] diphosphate}
seed.compound:cpd32867 seedM:cpd32867	(3R)-3-hydroxydodecanoyl-CoA (R)-3-hydroxydodecanoyl-CoA D-3-hydroxydodecanoyl-CoA
SLM:000399840 slm:000399840	(3R)-hydroxydodecanoyl-CoA
sabiork.compound:28587 sabiorkM:28587	(R)-3-Hydroxydodecanoyl-CoA
CHEBI:74451 chebi:74451	(R)-3-hydroxylauroyl-CoA (R)-3-hydroxydodecanoyl-CoA (R)-3-hydroxydodecanoyl-coenzyme A (R)-3-hydroxylauroyl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3R)-3-hydroxydodecanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
seedM:M_cpd32867	secondary/obsolete/fantasy identifier