trans-3-Hexenoyl-CoA

Base Information

Chemical Name:trans-3-Hexenoyl-CoA
CAS No.:6599-65-1
Molecular Formula:C27H44N7O17P3S
Molecular Weight:863.66
Hs Code.:
Metabolomics Workbench ID:38921
ChEMBL ID:CHEMBL1949903
Mol file:6599-65-1.mol

Synonyms:trans-3-Hexenoyl-CoA;{[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-2-{[({[(3-{[2-({2-[(3E)-hex-3-enoylsulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}-3-hydroxy-2,2-dimethylpropoxy)(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl)oxy]methyl}-4-hydroxyoxolan-3-yl]oxy}phosphonic acid;(E)-S-3-hexenoate;S-(3E)-3-hexenoate;(E)-S-3-hexenoic acid;(E)-S-3-hexenoate CoA;3-trans-Hexenoylcoenzyme A;S-(3E)-3-hexenoic acid;S-(3E)-3-hexenoate CoA;(E)-S-3-hexenoate Coenzyme A;CHEMBL1949903;S-(3E)-3-hexenoate Coenzyme A;LMFA07050387

Suppliers and Price of trans-3-Hexenoyl-CoA

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Total 1 raw suppliers

Chemical Property of trans-3-Hexenoyl-CoA

Chemical Property:

PSA：0.00000
LogP:0.00000
XLogP3:-4.2
Hydrogen Bond Donor Count:9
Hydrogen Bond Acceptor Count:22
Rotatable Bond Count:23
Exact Mass:863.17272513
Heavy Atom Count:55
Complexity:1490

Purity/Quality:: 98% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCC=CCC(=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
Isomeric SMILES:CC/C=C/CC(=O)SCCNC(=O)CCNC(=O)C(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

Technology Process of trans-3-Hexenoyl-CoA

There total 1 articles about trans-3-Hexenoyl-CoA which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

: 85-61-0
coenzyme A

: 6599-65-1
trans-3-hexenoylcoenzyme A

Guidance literature:

Reference yield:

: 6599-65-1
trans-3-hexenoylcoenzyme A

: 6701-39-9,10018-93-6
(2E)-hexenoyl-coenzyme A

Guidance literature:: With ethylenediaminetetraacetic acid; In phosphate buffer; at 25 ℃; pH=7.5; Further Variations:; Reagents; Enzyme kinetics;
DOI:10.1021/ol0712677

upstream raw materials:: coenzyme A

Downstream raw materials:: (2E)-hexenoyl-coenzyme A

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Encyclopedia

Technology Process of trans-3-Hexenoyl-CoA

trans-3-Hexenoyl-CoA

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