3-Decenoyl-CoA

CAT: 0931-TXB-00734-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0931-TXB-00734-01Size:10 mg

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CAS Number

6410-54-4

Target

Others

Related Pathways

Others

Bioactivity

3-Decenoyl-CoA (3-Decenoyl-coenzyme A) is a derivative of coenzyme A.

Smiles

O[C@H]1[C@H](N2C=3C(N=C2)=C(N)N=CN3)O[C@H](COP(OP(OCC([C@H](C(NCCC(NCCSC(C/C=C/CCCCCC)=O)=O)=O)O)(C)C)(=O)O)(=O)O)[C@H]1OP(=O)(O)O

Molecular Formula

C31H52N7O17P3S

Molecular Weight

919.77

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

trans-3-decenoyl-CoA

Trans-dec-3-enoyl-CoA is an unsaturated fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of trans-dec-3-enoic acid. It is a monounsaturated fatty acyl-CoA, a trans-3-enoyl-CoA and a medium-chain fatty acyl-CoA. It is functionally related to a trans-dec-3-enoic acid. It is a conjugate acid of a trans-dec-3-enoyl-CoA(4-).

CAS Number	6410-54-4
PubChem CID	16019966
IUPAC Name	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] (E)-dec-3-enethioate
Molecular Formula	C31H52N7O17P3S
Molecular Weight	919.8
XLogP	-2.1
Topological Polar Surface Area	389
Hydrogen Bond Donor Count	9
Hydrogen Bond Acceptor Count	22
Rotatable Bond Count	27
Heavy Atom Count	59
Formal Charge	0
Complexity	1560

SMILES

CCCCCC/C=C/CC(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O

InChI

InChI=1S/C31H52N7O17P3S/c1-4-5-6-7-8-9-10-11-22(40)59-15-14-33-21(39)12-13-34-29(43)26(42)31(2,3)17-52-58(49,50)55-57(47,48)51-16-20-25(54-56(44,45)46)24(41)30(53-20)38-19-37-23-27(32)35-18-36-28(23)38/h9-10,18-20,24-26,30,41-42H,4-8,11-17H2,1-3H3,(H,33,39)(H,34,43)(H,47,48)(H,49,50)(H2,32,35,36)(H2,44,45,46)/b10-9+/t20-,24-,25-,26+,30-/m1/s1

InChIKey

CQGVNMQHZQJNII-ZJZQAHHTSA-N

Chemical Structure

2D Structure

CAS: 6410-54-4

CID: 16019966

Formula: C31H52N7O17P3S

MW: 919.8

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	919.8
XLogP3	-2.1
Hydrogen Bond Donor Count	9
Hydrogen Bond Acceptor Count	22
Rotatable Bond Count	27
Exact Mass	919.23532538
Monoisotopic Mass	919.23532538
Topological Polar Surface Area	389 Å²
Heavy Atom Count	59
Formal Charge	0
Complexity	1560
Isotope Atom Count	0
Defined Atom Stereocenter Count	5
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Related Products

Catalog	Name
TYD-03628-01	9-Decenoyl-CoA
TYD-02494-01	3-Hydroxy-4-trans-decenoyl-CoA
TYD-02928-01	3-Oxooctanoyl-CoA
TYD-02915-01	3-Methyldecanoyl-CoA
TYD-02902-01	3-Isopropenylpimeloyl-CoA
TYD-02899-01	3-Methylheptanoyl-CoA
TYD-02896-01	3-Methylnonanedioyl-CoA
TYD-02890-01	3-Methyldocosanoyl-CoA
TYD-02883-01	3-Methylhexanoyl-CoA
TYD-02881-01	3-Methylhenicosanoyl-CoA

Alternative Products

Catalog	Name
HY-CE00850	3-Decenoyl-CoA
HY-CE01479	9-Decenoyl-CoA
HY-CE00886	3-Hydroxy-4-trans-decenoyl-CoA
TRC-D688830-50MG	trans-2-Decenoyl-L-carnitine
HY-CE01143	3-Oxooctanoyl-CoA
HY-CE01140	3-Methyltricosanoyl-CoA
HY-CE01135	3-Methylphenylalanine-CoA
HY-CE01132	3-Methyloctanoyl-CoA
HY-CE01124	3-Methylheptadecanoyl-CoA
HY-CE01121	3-Methylhenicosanoyl-CoA

3-Decenoyl-CoA

Chemical Information

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