Feedback

phytanoyl-CoA

MNXM741390 is deprecated and replaced by MNXM1104764

Properties

Image

Occurences in reactions

MNX_ID

MNXM1104764

	#reac
in my sandbox	0
in MNXref (generic)	6
in models (compartimentalized)	10

formula

C₄₁H₇₀N₇O₁₇P₃S

charge

-4

mass

1057.37837

reference

chebi:57391

InChIKey

NRJQGHHZMSOUEN-ZJGVPSKGSA-J

InChI

InChI=1S/C41H74N7O17P3S/c1-26(2)11-8-12-27(3)13-9-14-28(4)15-10-16-29(5)21-32(50)69-20-19-43-31(49)17-18-44-39(53)36(52)41(6,7)23-62-68(59,60)65-67(57,58)61-22-30-35(64-66(54,55)56)34(51)40(63-30)48-25-47-33-37(42)45-24-46-38(33)48/h24-30,34-36,40,51-52H,8-23H2,1-7H3,(H,43,49)(H,44,53)(H,57,58)(H,59,60)(H2,42,45,46)(H2,54,55,56)/p-4/t27?,28?,29?,30-,34-,35-,36+,40-/m1/s1

SMILES

CC(C)CCCC(C)CCCC(C)CCCC(C)CC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(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-]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:57391 chebi:57391	phytanoyl-CoA 3'-phosphonatoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3,7,11,15-tetramethylhexadecanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] diphosphate} phytanoyl-CoA(4-)
sabiork.compound:5973 sabiorkM:5973 kegg.compound:C02060 keggC:C02060	Phytanoyl-CoA
bigg.metabolite:phytcoa biggM:phytcoa	Phytanoyl-CoA(4-)
seed.compound:cpd01402 seedM:cpd01402	Phytanoyl-CoA phytanoyl-CoA
metacyc.compound:CPD-206 metacycM:CPD-206	phytanoyl-CoA
reactome:R-ALL-389615 reactomeM:R-ALL-389615 CHEBI:15538 chebi:15538	phytanoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3,7,11,15-tetramethylhexadecanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate} Phytanoyl-CoA
chebi:14835 chebi:26113 chebi:8190 biggM:M_phytcoa keggC:M_C02060 seedM:M_cpd01402	secondary/obsolete/fantasy identifier