1.1R:Et3N, S:CH2Cl2, 0°C; 0.5 h, rt
1.2R:HCl, S:H2O
2.1S:Benzene, rt; 4 h, reflux
2.2R:NaOH, S:H2O
3.1S:PhMe, 48 h, rt
4.1S:H2O, S:THF, overnight, rt, pH 8.5
5.1R:NaHCO3, C:Coenzyme II, reduced, S:H2O, 0.5 h, 30°C, pH 7
5.2R:Cl3CCO2H, S:H2O
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- 17331-98-5
Coenzyme A, S-nonanoate | 17331-98-5
Nome do produto：Coenzyme A, S-nonanoate
N.o CAS：17331-98-5
MF：C30H52N7O17P3S
MW：907.756980000001
CID：152927
- Coenzyme A, S-nonanoate(8CI,9CI)
- nonanoyl-coenzyme A
- Nonanoyl Coenzyme A
- 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]ethy
- Coenzyme A, nonanoyl-
- Coenzyme A, S-nonanoate
- Nonanoyl-coa
- S-{(9R)-1-[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]-3,5,9-trihydroxy-8,8-dimethyl-3,5-dioxido-10,14-dioxo-2,4,6-trioxa-11,15-diaza-3lambda~5~,5lambda~5~-diphosphaheptadecan-17-yl} nonanethioate (non-preferred name)
- Nonanoyl CoA
- Adenosine 3'-phosphoric acid 5'-[diphosphoric acid P2-[2,2-dimethyl-3-hydroxy-3-[[2-[[2-(nonanoylthio)ethyl]aminocarbonyl]ethyl]aminocarbonyl]propyl]] ester
- Pelargonoyl-CoA
- Nonanoyl-CoA
- Pelargonoyl-CoA
- InChIKey：WLDUTYVSAGSKIV-FUEUKBNZSA-N
- Inchi：InChI=1S/C30H52N7O17P3S/c1-4-5-6-7-8-9-10-21(39)58-14-13-32-20(38)11-12-33-28(42)25(41)30(2,3)16-51-57(48,49)54-56(46,47)50-15-19-24(53-55(43,44)45)23(40)29(52-19)37-18-36-22-26(31)34-17-35-27(22)37/h17-19,23-25,29,40-41H,4-16H2,1-3H3,(H,32,38)(H,33,42)(H,46,47)(H,48,49)(H2,31,34,35)(H2,43,44,45)/t19-,23-,24-,25+,29-/m1/s1
- SMILES：CCCCCCCCC(SCCNC(CCNC([C@@H](C(COP(OP(OC[C@H]1O[C@@H](N2C=NC3C(=NC=NC2=3)N)[C@H](O)[C@@H]1OP(=O)(O)O)(O)=O)(O)=O)(C)C)O)=O)=O)=O
Circuito Sintético 1
Condições de reacção + Expandir
Referência
- Multiplexing of Combinatorial Chemistry in Antimycin Biosynthesis: Expansion of Molecular Diversity and Utility, Angewandte Chemie, 2013, 52(47), 12308-12312
Circuito Sintético 2
Condições de reacção + Expandir
1.1R:R:MgCl2, R:Glycerol, R:C:9013-18-7, S:H2O, 60 min, 25°C
1.2R:HCO2H
1.2R:HCO2H
Referência
- Identification of Middle Chain Fatty Acyl-CoA Ligase Responsible for the Biosynthesis of 2-Alkylmalonyl-CoAs for Polyketide Extender Unit, Journal of Biological Chemistry, 2015, 290(45), 26994-27011
-
Acetyl CoA N.o CAS.: 102029-73-2 -
Coenzyme A N.o CAS.: 85-61-0 -
-
-
Coenzyme A, S-octanoate N.o CAS.: 1264-52-4 -
Coenzyme A,S-hexadecanoate N.o CAS.: 1763-10-6 -
Coenzyme A,S-(9Z)-9-octadecenoate N.o CAS.: 1716-06-9 -
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