2-Hydroxyoctadecanoyl-coenzyme A (ammonium salt)

Name: 2-Hydroxyoctadecanoyl-coenzyme A (ammonium salt)
Brand: BOC Sciences
Rating: 5 (1 reviews)

CAS No.: 38861-93-7

Cat No.: BPG-3084

Purity: >99%

4.5

2-Hydroxyoctadecanoyl-coenzyme A is a coenzyme A derivative that contains a long chain fatty acid with a hydroxyl group attached at the second carbon. It is commonly used in the synthesis of various lipids in biological systems. The ammonium salt form of this compound is often used in research settings as a stable and water-soluble form of the molecule.

Category	Acyl CoA - Unsaturated Fatty Acid
Molecular Formula	C39H79N10O18P3S
Molecular Weight	1100.45
Appearance	Powder
Storage	Store at -20°C

2-Hydroxyoctadecanoyl-coenzyme A (ammonium salt)

Structure of 38861-93-7

Ordering Information

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Specification

Synonyms	α-hydroxy stearoyl Coenzyme A (ammonium salt); alpha-hydroxy octadecanoyl Coenzyme A (ammonium salt); 18:0(α-OH) Coenzyme A (ammonium salt)
IUPACName	S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] (2S)-2-hydroxyoctadecanethioate
CanonicalSMILES	CCCCCCCCCCCCCCCCC(C(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O)O
InChI	InChI=1S/C39H70N7O18P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-27(47)38(52)68-22-21-41-29(48)19-20-42-36(51)33(50)39(2,3)24-61-67(58,59)64-66(56,57)60-23-28-32(63-65(53,54)55)31(49)37(62-28)46-26-45-30-34(40)43-25-44-35(30)46/h25-28,31-33,37,47,49-50H,4-24H2,1-3H3,(H,41,48)(H,42,51)(H,56,57)(H,58,59)(H2,40,43,44)(H2,53,54,55)/t27-,28+,31+,32+,33-,37+/m0/s1
InChIKey	OJQMIXCIJFLULT-LPSUQUFLSA-N
Purity	>99%
ShelfLife	1 Year
ExactMass	1101.087
Hygroscopic	No
LightSensitive	No
PercentComposition	C 42.54%, H 7.23%, N 12.72%, O 26.15%, P 8.44%, S 2.91%