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(7Z)-tetradecenoyl-CoA

MNXM163972 is deprecated and here replaced by MNXM1102104
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1102104 Image of MNXM1102104
referencechebi:232643
formulaC35H56N7O17P3S
global charge-4
mol weight971.854
InChIKeyJPIHVKICKVPFFY-TWAFKMGKSA-J
InChIInChI=1S/C35H60N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-26(44)63-19-18-37-25(43)16-17-38-33(47)30(46)35(2,3)21-56-62(53,54)59-61(51,52)55-20-24-29(58-60(48,49)50)28(45)34(57-24)42-23-41-27-31(36)39-22-40-32(27)42/h9-10,22-24,28-30,34,45-46H,4-8,11-21H2,1-3H3,(H,37,43)(H,38,47)(H,51,52)(H,53,54)(H2,36,39,40)(H2,48,49,50)/p-4/b10-9-/t24-,28-,29-,30+,34-/m1/s1
SMILESCCCCCC/C=C\CCCCCC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)([O-])OP(=O)([O-])OC[C@H]1O[C@@H](N2C=NC3=C2N=CN=C3N)[C@H](O)[C@@H]1OP(=O)([O-])[O-]
MNX internals
InChI (mnx)InChI=1/C35H60N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-26(44)63-19-18-37-25(43)16-17-38-33(47)30(46)35(2,3)21-56-62(53,54)59-61(51,52)55-20-24-29(58-60(48,49)50)28(45)34(57-24)42-23-41-27-31(36)39-22-40-32(27)42/h9-10,22-24,28-30,34,45-46H,4-8,11-21H2,1-3H3,(H,37,43)(H,38,47)(H,51,52)(H,53,54)(H2,36,39,40)(H2,48,49,50)/b10-9-/t24-,28-,29-,30+,34-/m1/s1 Image of MNXM1102104
SMILES (mnx)[CH3:1][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8]/[CH:9]=[CH:10]\[CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][C:26](=[O:44])[S:63][CH2:19][CH2:18][N:37]=[C:25]([CH2:16][CH2:17][N:38]=[C:33]([C@@H:30]([C:35]([CH3:2])([CH3:3])[CH2:21][O:56][P:62]([OH:53])(=[O:54])[O:59][P:61]([OH:51])(=[O:52])[O:55][CH2:20][C@@H:24]1[C@@H:29]([O:58][P:60]([OH:48])([OH:49])=[O:50])[C@@H:28]([OH:45])[C@H:34]([N:42]2[CH:23]=[N:41][C:27]3=[C:31]([NH2:36])[N:39]=[CH:22][N:40]=[C:32]32)[O:57]1)[OH:46])[OH:47])[OH:43]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)6
in models (compartimentalized) 3
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:232643
chebi:232643
JPIHVKICKVPFFY-TWAFKMGKSA-J 		(7Z)-tetradecenoyl-CoA
(Z)-tetradec-7-enoyl-CoA(4-)
14:1(7Z)-CoA(4-)

seed.compound:cpd31619
seedM:cpd31619
JPIHVKICKVPFFY-TWAFKMGKSA-J 		(7Z)-tetradec-7-enoyl-CoA
(7Z)-tetradecenoyl-CoA
14:1(n-7)-CoA
14:1-delta7-CoA
cis-7-tetradecenoyl-CoA

metacyc.compound:CPD-19147
metacycM:CPD-19147
JPIHVKICKVPFFY-TWAFKMGKSA-J 		(7Z)-tetradecenoyl-CoA
(7Z)-tetradec-7-enoyl-CoA
14:1(n-7)-CoA
14:1-Delta7-CoA
cis-7-tetradecenoyl-CoA

bigg.metabolite:tetd7ecoa
biggM:tetd7ecoa
JPIHVKICKVPFFY-TWAFKMGKSA-J 		7-Tetradecenoyl Coenzyme A

lipidmaps:LMFA07050476
lipidmapsM:LMFA07050476
JPIHVKICKVPFFY-TWAFKMGKSA-N 		7Z-tetradecenoyl-CoA
7Z-tetradecenoyl-CoA
CoA 14:1

vmhM:CE0784
vmhmetabolite:CE0784
JPIHVKICKVPFFY-TWAFKMGKSA-J 		cis-myrist-7-enoyl-CoA

biggM:M_tetd7ecoa
seedM:M_cpd31619
vmhM:M_CE0784 		secondary/obsolete/fantasy identifier