1.0 2010-04-08 22:13:11 UTC 2025-11-19 01:55:34 UTC FDB017588 Pediocin AcH Isolated from Pediococcus acidilacici PAC-10 and 43200 Pediocin AcH C196H297N61O60S5 4628.2 4625.066781877 111745-56-3 [H][C@](C)(O)[C@]([H])(N=C(O)[C@]([H])(C)N=C(O)[C@]([H])(CC1=CNC2=CC=CC=C12)N=C(O)[C@]([H])(C)N=C(O)[C@]([H])(CCSC)N=C(O)[C@]([H])(C)N=C(O)CN=C(O)[C@]([H])(CC(O)=N)N=C(O)[C@]([H])(CC(O)=N)N=C(O)[C@@]([H])(N=C(O)[C@@]([H])(N=C(O)[C@]([H])(CS)N=C(O)[C@@]([H])(N=C(O)[C@@]([H])(N=C(O)[C@]([H])(C)N=C(O)[C@]([H])(CCCCN)N=C(O)CN=C(O)[C@]([H])(CC1=CNC2=CC=CC=C12)N=C(O)[C@]([H])(CC(O)=O)N=C(O)[C@@]([H])(N=C(O)[C@]([H])(CO)N=C(O)[C@]([H])(CS)N=C(O)[C@]([H])(CO)N=C(O)[C@]([H])(CC1([H])C=NC=N1)N=C(O)[C@]([H])(CCCCN)N=C(O)CN=C(O)[C@]([H])(CS)N=C(O)[C@@]([H])(N=C(O)[C@@]([H])(N=C(O)CN=C(O)[C@]([H])(CC(O)=N)N=C(O)CN=C(O)[C@]([H])(CC1=CC=C(O)C=C1)N=C(O)[C@]([H])(CC1=CC=C(O)C=C1)N=C(O)[C@@]([H])(N)CCCCN)C(C)C)[C@@]([H])(C)O)C(C)C)[C@@]([H])(C)O)[C@@]([H])(C)O)[C@@]([H])(C)CC)[C@@]([H])(C)CC)C(O)=NCC(O)=NCC(O)=N[C@@]([H])(CC1([H])C=NC=N1)C(O)=N[C@@]([H])(CCC(O)=N)C(O)=NCC(O)=N[C@@]([H])(CC(O)=N)C(=O)OC(=O)[C@]([H])(CS)N=C(O)[C@]([H])(CCCCN)N=C(O)[C@@]([H])(N)CC1([H])C=NC=N1 InChI=1S/C196H297N61O60S5/c1-18-92(7)155(190(310)242-130(65-142(206)269)181(301)241-129(64-141(205)268)171(291)215-75-145(272)224-94(9)161(281)233-121(50-55-322-17)174(294)225-95(10)162(282)236-125(59-105-69-212-116-36-23-21-33-112(105)116)177(297)227-97(12)163(283)254-157(98(13)260)187(307)220-73-144(271)213-74-146(273)230-126(61-107-71-209-88-222-107)179(299)235-120(48-49-139(203)266)167(287)214-79-150(277)232-132(66-143(207)270)195(315)317-196(316)138(86-321)249-176(296)119(39-27-31-54-200)234-166(286)114(202)60-106-70-208-87-221-106)253-191(311)156(93(8)19-2)252-186(306)137(85-320)248-193(313)159(100(15)262)257-194(314)160(101(16)263)255-164(284)96(11)226-173(293)117(37-25-29-52-198)228-147(274)76-217-169(289)124(58-104-68-211-115-35-22-20-32-111(104)115)239-182(302)131(67-152(279)280)243-188(308)154(91(5)6)251-184(304)134(82-259)245-185(305)136(84-319)246-183(303)133(81-258)244-180(300)127(62-108-72-210-89-223-108)240-175(295)118(38-26-30-53-199)229-148(275)77-219-172(292)135(83-318)247-192(312)158(99(14)261)256-189(309)153(90(3)4)250-151(278)80-218-170(290)128(63-140(204)267)231-149(276)78-216-168(288)122(56-102-40-44-109(264)45-41-102)238-178(298)123(57-103-42-46-110(265)47-43-103)237-165(285)113(201)34-24-28-51-197/h20-23,32-33,35-36,40-47,68-72,87-101,106-108,113-114,117-138,153-160,211-212,258-265,318-321H,18-19,24-31,34,37-39,48-67,73-86,197-202H2,1-17H3,(H2,203,266)(H2,204,267)(H2,205,268)(H2,206,269)(H2,207,270)(H,213,271)(H,214,287)(H,215,291)(H,216,288)(H,217,289)(H,218,290)(H,219,292)(H,220,307)(H,224,272)(H,225,294)(H,226,293)(H,227,297)(H,228,274)(H,229,275)(H,230,273)(H,231,276)(H,232,277)(H,233,281)(H,234,286)(H,235,299)(H,236,282)(H,237,285)(H,238,298)(H,239,302)(H,240,295)(H,241,301)(H,242,310)(H,243,308)(H,244,300)(H,245,305)(H,246,303)(H,247,312)(H,248,313)(H,249,296)(H,250,278)(H,251,304)(H,252,306)(H,253,311)(H,254,283)(H,255,284)(H,256,309)(H,257,314)(H,279,280)/t92-,93-,94-,95-,96-,97-,98+,99+,100+,101+,106?,107?,108?,113-,114-,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,138-,153-,154-,155-,156-,157-,158-,159-,160-/m0/s1 FLTWKHKMXZLDNR-CVMNUACMSA-N belongs to the class of organic compounds known as polypeptides. These are peptides containing ten or more amino acid residues. Polypeptides Organic compounds Organic Polymers Polypeptides Aromatic heteropolycyclic compounds 1-hydroxy-2-unsubstituted benzenoids 3-alkylindoles Alanine and derivatives Alkylthiols Alpha amino acid amides Amino acids Amphetamines and derivatives Asparagine and derivatives Aspartic acid and derivatives Azacyclic compounds Carbonyl compounds Carboxylic acid anhydrides Carboxylic acids Cysteine and derivatives Dialkylthioethers Glutamine and derivatives Heteroaromatic compounds Hydrocarbon derivatives Imidazoles Isoleucine and derivatives Methionine and derivatives Monoalkylamines N-acyl amines N-acyl-alpha amino acids and derivatives Organic oxides Organopnictogen compounds Peptides Phenylalanine and derivatives Primary alcohols Primary carboxylic acid amides Propargyl-type 1,3-dipolar organic compounds Secondary alcohols Secondary carboxylic acid amides Serine and derivatives Substituted pyrroles Sulfenyl compounds Tricarboxylic acids and derivatives Tryptamines and derivatives Tyrosine and derivatives Valine and derivatives 1-hydroxy-2-unsubstituted benzenoid 3-alkylindole Alanine or derivatives Alcohol Alkylthiol Alpha peptide Alpha-amino acid amide Alpha-amino acid or derivatives Amine Amino acid Amino acid or derivatives Amphetamine or derivatives Aromatic heteropolycyclic compound Asparagine or derivatives Aspartic acid or derivatives Azacycle Benzenoid Carbonyl group Carboxamide group Carboxylic acid Carboxylic acid anhydride Carboxylic acid derivative Cysteine or derivatives Dialkylthioether Fatty acyl Fatty amide Glutamine or derivatives Heteroaromatic compound Hydrocarbon derivative Imidazole Indole Indole or derivatives Isoleucine or derivatives Methionine or derivatives Monocyclic benzene moiety N-acyl-alpha amino acid or derivatives N-acyl-amine N-substituted-alpha-amino acid Organic 1,3-dipolar compound Organic nitrogen compound Organic oxide Organic oxygen compound Organoheterocyclic compound Organonitrogen compound Organooxygen compound Organopnictogen compound Organosulfur compound Phenol Phenylalanine or derivatives Polypeptide Primary alcohol Primary aliphatic amine Primary amine Primary carboxylic acid amide Propargyl-type 1,3-dipolar organic compound Pyrrole Secondary alcohol Secondary carboxylic acid amide Serine or derivatives Substituted pyrrole Sulfenyl compound Thioether Tricarboxylic acid or derivatives Triptan Tyrosine or derivatives Valine or derivatives average_mass 4628.2 ChemAxon mono_mass 4625.066781877 ChemAxon smiles [H][C@](C)(O)[C@]([H])(N=C(O)[C@]([H])(C)N=C(O)[C@]([H])(CC1=CNC2=CC=CC=C12)N=C(O)[C@]([H])(C)N=C(O)[C@]([H])(CCSC)N=C(O)[C@]([H])(C)N=C(O)CN=C(O)[C@]([H])(CC(O)=N)N=C(O)[C@]([H])(CC(O)=N)N=C(O)[C@@]([H])(N=C(O)[C@@]([H])(N=C(O)[C@]([H])(CS)N=C(O)[C@@]([H])(N=C(O)[C@@]([H])(N=C(O)[C@]([H])(C)N=C(O)[C@]([H])(CCCCN)N=C(O)CN=C(O)[C@]([H])(CC1=CNC2=CC=CC=C12)N=C(O)[C@]([H])(CC(O)=O)N=C(O)[C@@]([H])(N=C(O)[C@]([H])(CO)N=C(O)[C@]([H])(CS)N=C(O)[C@]([H])(CO)N=C(O)[C@]([H])(CC1([H])C=NC=N1)N=C(O)[C@]([H])(CCCCN)N=C(O)CN=C(O)[C@]([H])(CS)N=C(O)[C@@]([H])(N=C(O)[C@@]([H])(N=C(O)CN=C(O)[C@]([H])(CC(O)=N)N=C(O)CN=C(O)[C@]([H])(CC1=CC=C(O)C=C1)N=C(O)[C@]([H])(CC1=CC=C(O)C=C1)N=C(O)[C@@]([H])(N)CCCCN)C(C)C)[C@@]([H])(C)O)C(C)C)[C@@]([H])(C)O)[C@@]([H])(C)O)[C@@]([H])(C)CC)[C@@]([H])(C)CC)C(O)=NCC(O)=NCC(O)=N[C@@]([H])(CC1([H])C=NC=N1)C(O)=N[C@@]([H])(CCC(O)=N)C(O)=NCC(O)=N[C@@]([H])(CC(O)=N)C(=O)OC(=O)[C@]([H])(CS)N=C(O)[C@]([H])(CCCCN)N=C(O)[C@@]([H])(N)CC1([H])C=NC=N1 ChemAxon formula C196H297N61O60S5 ChemAxon inchi InChI=1S/C196H297N61O60S5/c1-18-92(7)155(190(310)242-130(65-142(206)269)181(301)241-129(64-141(205)268)171(291)215-75-145(272)224-94(9)161(281)233-121(50-55-322-17)174(294)225-95(10)162(282)236-125(59-105-69-212-116-36-23-21-33-112(105)116)177(297)227-97(12)163(283)254-157(98(13)260)187(307)220-73-144(271)213-74-146(273)230-126(61-107-71-209-88-222-107)179(299)235-120(48-49-139(203)266)167(287)214-79-150(277)232-132(66-143(207)270)195(315)317-196(316)138(86-321)249-176(296)119(39-27-31-54-200)234-166(286)114(202)60-106-70-208-87-221-106)253-191(311)156(93(8)19-2)252-186(306)137(85-320)248-193(313)159(100(15)262)257-194(314)160(101(16)263)255-164(284)96(11)226-173(293)117(37-25-29-52-198)228-147(274)76-217-169(289)124(58-104-68-211-115-35-22-20-32-111(104)115)239-182(302)131(67-152(279)280)243-188(308)154(91(5)6)251-184(304)134(82-259)245-185(305)136(84-319)246-183(303)133(81-258)244-180(300)127(62-108-72-210-89-223-108)240-175(295)118(38-26-30-53-199)229-148(275)77-219-172(292)135(83-318)247-192(312)158(99(14)261)256-189(309)153(90(3)4)250-151(278)80-218-170(290)128(63-140(204)267)231-149(276)78-216-168(288)122(56-102-40-44-109(264)45-41-102)238-178(298)123(57-103-42-46-110(265)47-43-103)237-165(285)113(201)34-24-28-51-197/h20-23,32-33,35-36,40-47,68-72,87-101,106-108,113-114,117-138,153-160,211-212,258-265,318-321H,18-19,24-31,34,37-39,48-67,73-86,197-202H2,1-17H3,(H2,203,266)(H2,204,267)(H2,205,268)(H2,206,269)(H2,207,270)(H,213,271)(H,214,287)(H,215,291)(H,216,288)(H,217,289)(H,218,290)(H,219,292)(H,220,307)(H,224,272)(H,225,294)(H,226,293)(H,227,297)(H,228,274)(H,229,275)(H,230,273)(H,231,276)(H,232,277)(H,233,281)(H,234,286)(H,235,299)(H,236,282)(H,237,285)(H,238,298)(H,239,302)(H,240,295)(H,241,301)(H,242,310)(H,243,308)(H,244,300)(H,245,305)(H,246,303)(H,247,312)(H,248,313)(H,249,296)(H,250,278)(H,251,304)(H,252,306)(H,253,311)(H,254,283)(H,255,284)(H,256,309)(H,257,314)(H,279,280)/t92-,93-,94-,95-,96-,97-,98+,99+,100+,101+,106?,107?,108?,113-,114-,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,138-,153-,154-,155-,156-,157-,158-,159-,160-/m0/s1 ChemAxon inchikey FLTWKHKMXZLDNR-CVMNUACMSA-N ChemAxon