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(9Z)-tetradecenoyl-CoA

PropertiesImage
MNX_IDMNXM1103805 Image of MNXM1103805
referencechebi:65060
formulaC35H56N7O17P3S
global charge-4
mol weight971.854
InChIKeyGIIFECKTWKZXGU-FJXLYLFVSA-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/h7-8,22-24,28-30,34,45-46H,4-6,9-21H2,1-3H3,(H,37,43)(H,38,47)(H,51,52)(H,53,54)(H2,36,39,40)(H2,48,49,50)/p-4/b8-7-/t24-,28-,29-,30+,34-/m1/s1
SMILESCCCC/C=C\CCCCCCCC(=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/h7-8,22-24,28-30,34,45-46H,4-6,9-21H2,1-3H3,(H,37,43)(H,38,47)(H,51,52)(H,53,54)(H2,36,39,40)(H2,48,49,50)/b8-7-/t24-,28-,29-,30+,34-/m1/s1 Image of MNXM1103805
SMILES (mnx)[CH3:1][CH2:4][CH2:5][CH2:6]/[CH:7]=[CH:8]\[CH2:9][CH2:10][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)10
in models (compartimentalized) 7
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:65060
chebi:65060
GIIFECKTWKZXGU-FJXLYLFVSA-J 		(9Z)-tetradecenoyl-CoA
(9Z)-myristoleoyl-CoA(4-)
(9Z)-myristoleoyl-coenzyme A(4-)
(Z)-tetradec-9-enoyl-CoA(4-)
(Z)-tetradec-9-enoyl-coenzyme A(4-)
cis-tetradec-9-enoyl-CoA(4-)
cis-tetradec-9-enoyl-coenzyme A(4-)
myristoleoyl-CoA(4-)
myristoleoyl-coenzyme A(4-)

CHEBI:65087
chebi:65087
GIIFECKTWKZXGU-FJXLYLFVSA-N 		(9Z)-myristoleoyl-CoA
(9Z)-myristoleoyl-coenzyme A
(Z)-tetradec-9-enoyl-CoA
(Z)-tetradec-9-enoyl-coenzyme A
3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-{[(9Z)-tetradec-9-enoyl]sulfanyl}ethyl)amino]propyl}amino)butyl] dihydrogen diphosphate}
cis-tetradec-9-enoyl-CoA
cis-tetradec-9-enoyl-coenzyme A
myristoleoyl-CoA
myristoleoyl-coenzyme A

lipidmaps:LMFA07050135
lipidmapsM:LMFA07050135
GIIFECKTWKZXGU-FJXLYLFVSA-N 		(9Z)-myristoleoyl-CoA
(9Z)-myristoleoyl-coenzyme A
(Z)-tetradec-9-enoyl-CoA
(Z)-tetradec-9-enoyl-coenzyme A
9Z-tetradecenoyl-CoA
CoA 14:1
cis-tetradec-9-enoyl-CoA
cis-tetradec-9-enoyl-coenzyme A
myristoleoyl-CoA
myristoleoyl-coenzyme A

metacyc.compound:CPD-17464
metacycM:CPD-17464
seed.compound:cpd34204
seedM:cpd34204
SLM:000000629
slm:000000629
GIIFECKTWKZXGU-FJXLYLFVSA-J 		(9Z)-tetradecenoyl-CoA
hmdb:HMDB0112236
GIIFECKTWKZXGU-FJXLYLFVSA-N 		Myristoleoyl-CoA
(9Z)-Myristoleoyl-coenzyme A
(9Z)-myristoleoyl-CoA
(Z)-Tetradec-9-enoyl-CoA
(Z)-Tetradec-9-enoyl-coenzyme A
CoA(14:1(9Z))
Myristoleoyl-coenzyme A
[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-({[hydroxy([hydroxy((3R)-3-hydroxy-2,2-dimethyl-3-{[2-({2-[(9Z)-tetradec-9-enoylsulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}propoxy)phosphoryl]oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxyphosphonic acid
cis-Tetradec-9-enoyl-CoA
cis-Tetradec-9-enoyl-coenzyme A
{[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[(3R)-3-hydroxy-2,2-dimethyl-3-{[2-({2-[(9Z)-tetradec-9-enoylsulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}propoxy]phosphoryl}oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid

sabiork.compound:28896
sabiorkM:28896
GIIFECKTWKZXGU-FJXLYLFVSA-N 		Myristoleoyl-CoA
cis-Tetradec-9-enoyl-CoA

seedM:M_cpd34204 		secondary/obsolete/fantasy identifier