2-hydroxyphytanoyl-CoA (CHEBI:15475)

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CHEBI:15475 - 2-hydroxyphytanoyl-CoA

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ChEBI ID	CHEBI:15475
ChEBI Name	2-hydroxyphytanoyl-CoA
Stars
Definition	A multi-methyl-branched fatty acyl-CoA having 2-hydroxyphytanoyl as the S-acyl group.
Secondary ChEBI IDs	CHEBI:1170, CHEBI:11600, CHEBI:19657
Last Modified	31 March 2015
Submitter	Marcus Ennis
Downloads	Molfile

Formula	C41H74N7O18P3S
Net Charge	0
Average Mass	1078.063
Monoisotopic Mass	1077.40239
SMILES	CC(C)CCCC(C)CCCC(C)CCCC(C)C(O)C(=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
InChI	InChI=1S/C41H74N7O18P3S/c1-25(2)11-8-12-26(3)13-9-14-27(4)15-10-16-28(5)32(50)40(54)70-20-19-43-30(49)17-18-44-38(53)35(52)41(6,7)22-63-69(60,61)66-68(58,59)62-21-29-34(65-67(55,56)57)33(51)39(64-29)48-24-47-31-36(42)45-23-46-37(31)48/h23-29,32-35,39,50-52H,8-22H2,1-7H3,(H,43,49)(H,44,53)(H,58,59)(H,60,61)(H2,42,45,46)(H2,55,56,57)/t26?,27?,28?,29-,32?,33-,34-,35+,39-/m1/s1
InChIKey	WNVFJMYPVBOLKV-YLNUKALLSA-N

Roles Classification

acyl donor Any donor that can transfer acyl groups between molecular entities.

ChEBI Ontology

Outgoing Relation(s)
	2-hydroxyphytanoyl-CoA (CHEBI:15475) has functional parent 2-hydroxyphytanic acid (CHEBI:37258)
	2-hydroxyphytanoyl-CoA (CHEBI:15475) has functional parent phytanoyl-CoA (CHEBI:15538)
	2-hydroxyphytanoyl-CoA (CHEBI:15475) is a 11,12-saturated fatty acyl-CoA (CHEBI:85348)
	2-hydroxyphytanoyl-CoA (CHEBI:15475) is a hydroxy fatty acyl-CoA (CHEBI:61902)
	2-hydroxyphytanoyl-CoA (CHEBI:15475) is a long-chain fatty acyl-CoA (CHEBI:33184)
	2-hydroxyphytanoyl-CoA (CHEBI:15475) is a multi-methyl-branched fatty acyl-CoA (CHEBI:18100)
	2-hydroxyphytanoyl-CoA (CHEBI:15475) is conjugate acid of 2-hydroxyphytanoyl-CoA(4−) (CHEBI:57334)
Incoming Relation(s)
Incoming Relation(s)	2-hydroxyphytanoyl-CoA(4−) (CHEBI:57334) is conjugate base of 2-hydroxyphytanoyl-CoA (CHEBI:15475)

IUPAC Name
3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(2-hydroxy-3,7,11,15-tetramethylhexadecanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}

Synonyms	Source
2-Hydroxyphytanoyl-CoA	KEGG COMPOUND
α-hydroxyphytanoyl-CoA	ChEBI
α-hydroxy-3,7,11,15-tetramethylhexadecanoyl-coenzyme A	ChEBI
2-hydroxy-3,7,11,15-tetramethylhexadecanoyl-CoA	ChEBI
α-hydroxy-3,7,11,15-tetramethylhexadecanoyl-CoA	ChEBI
2-hydroxyphytanoyl-coenzyme A	ChEBI

Manual Xrefs	Databases
C07343	KEGG COMPOUND
C07343	KEGG COMPOUND
HMDB0001295	HMDB

Citations