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crotonobetainyl-CoA

PropertiesImageOccurences in reactions
MNX_IDMNXM732837Image of MNXM732837
#reac
in my sandbox 0
in MNXref (generic)12
in models (compartimentalized) 8
formulaC28H44N8O17P3S
charge-3
mass889.17744
referencechebi:60933
InChIKeyWAUPBDVHJXXZGW-HXPULJKESA-K
InChIInChI=1S/C28H47N8O17P3S/c1-28(2,23(40)26(41)31-9-8-18(37)30-10-12-57-19(38)7-6-11-36(3,4)5)14-50-56(47,48)53-55(45,46)49-13-17-22(52-54(42,43)44)21(39)27(51-17)35-16-34-20-24(29)32-15-33-25(20)35/h6-7,15-17,21-23,27,39-40H,8-14H2,1-5H3,(H7-,29,30,31,32,33,37,41,42,43,44,45,46,47,48)/p-3/b7-6+/t17-,21-,22-,23+,27-/m1/s1
SMILESCC(C)(COP(=O)([O-])OP(=O)([O-])OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)([O-])[O-])[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)/C=C/C[N+](C)(C)C
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
CHEBI:60933
chebi:60933
crotonobetainyl-CoA
(E)-4-(trimethylammonio)but-2-enoyl-CoA trianion
(E)-4-(trimethylammonio)but-2-enoyl-CoA(3-)
crotonobetainyl-CoA trianion
crotonobetainyl-CoA(3-)
crotonobetainyl-coenzyme A trianion
crotonobetainyl-coenzyme A(3-)
kegg.compound:C20748
keggC:C20748
(E)-4-(Trimethylammonio)but-2-enoyl-CoA
Crotonobetainyl-CoA
lipidmaps:LMFA07050143
lipidmapsM:LMFA07050143
(E)-4-(trimethylammonio)but-2-enoyl-CoA
(E)-4-(trimethylammonio)but-2-enoyl-coenzyme A
4-trimethylammonio-2E-butenoyl-CoA
crotonobetainyl-CoA
crotonobetainyl-coenzyme A
CHEBI:61123
chebi:61123
(E)-4-(trimethylammonio)but-2-enoyl-CoA
(E)-4-(trimethylammonio)but-2-enoyl-coenzyme A
crotonobetainyl-CoA
crotonobetainyl-coenzyme A
bigg.metabolite:ctbtcoa
biggM:ctbtcoa
Crotonobetainyl-CoA
sabiork.compound:31695
sabiorkM:31695
Crotonobetainyl-CoA
(E)-4-(Trimethylammonio)but-2-enoyl-CoA
seed.compound:cpd15441
seedM:cpd15441
crotonobetainyl-CoA
(E)-4-(Trimethylammonio)but-2-enoyl-CoA
(E)-4-(trimethylammonio)but-2-enoyl-CoA
Crotonobetainyl-CoA
ctbtcoa
metacyc.compound:CROTONOBETAINYL-COA
metacycM:CROTONOBETAINYL-COA
crotonobetainyl-CoA
(E)-4-(trimethylammonio)but-2-enoyl-CoA
biggM:M_ctbtcoa
keggC:M_C20748
seedM:M_cpd15441
secondary/obsolete/fantasy identifier