Name: Lariatin A
CAS#: 732286-09-8
Chemical Formula: C94H143N27O25
Exact Mass: 2050.0748
Molecular Weight: 2051.34
Elemental Analysis: C, 55.04; H, 7.03; N, 18.44; O, 19.50
Description: Lariatin A is an antimycobacterial lasso peptide active against M. tuberculosis and M. smegmatis. Lariatin A increases survival in a silkworm model of M. smegmatis infection.
IUPAC/Chemical Name: (8→1)-lactam glycyl-L-seryl-L-glutaminyl-L-leucyl-L-valyl-L-tyrosyl-L-arginyl-L-α-glutamyl-L-tryptophyl-L-valylglycyl-L-histidyl-L-seryl-L-asparaginyl-L-valyl-L-isoleucyl-L-lysyl-L-proline
InChi Key: ZYWDOXCVVHITIW-KBACZRJDSA-N
InChi Code: InChI=1S/C94H143N27O25/c1-11-50(10)77(91(143)111-60(20-14-15-31-95)92(144)121-33-17-22-68(121)93(145)146)120-90(142)76(49(8)9)119-85(137)65(38-70(97)126)114-87(139)67(44-123)116-82(134)64(37-53-40-100-45-105-53)106-73(129)42-104-88(140)74(47(4)5)117-84(136)63(36-52-39-102-56-19-13-12-18-55(52)56)113-80(132)59-28-30-71(127)103-41-72(128)107-66(43-122)86(138)110-58(27-29-69(96)125)79(131)112-61(34-46(2)3)83(135)118-75(48(6)7)89(141)115-62(35-51-23-25-54(124)26-24-51)81(133)108-57(78(130)109-59)21-16-32-101-94(98)99/h12-13,18-19,23-26,39-40,45-50,57-68,74-77,102,122-124H,11,14-17,20-22,27-38,41-44,95H2,1-10H3,(H2,96,125)(H2,97,126)(H,100,105)(H,103,127)(H,104,140)(H,106,129)(H,107,128)(H,108,133)(H,109,130)(H,110,138)(H,111,143)(H,112,131)(H,113,132)(H,114,139)(H,115,141)(H,116,134)(H,117,136)(H,118,135)(H,119,137)(H,120,142)(H,145,146)(H4,98,99,101)/t50-,57-,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-,68-,74-,75-,76-,77-/m0/s1
SMILES Code: O=C(N[C@@H](CCCNC(N)=N)C(N[C@H](C(N[C@@H](CC1=CNC2=C1C=CC=C2)C(N[C@@H](C(C)C)C(NCC(N[C@@H](CC3=CN=CN3)C(N[C@@H](CO)C(N[C@@H](CC(N)=O)C(N[C@@H](C(C)C)C(N[C@]([C@@H](C)CC)([H])C(N[C@@H](CCCCN)C(N4CCC[C@H]4C(O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)CCC(NCC(N[C@@H](CO)C(N[C@H]5CCC(N)=O)=O)=O)=O)=O)[C@@](CC6=CC=C(O)C=C6)([H])NC([C@H](C(C)C)NC([C@@](CC(C)C)([H])NC5=O)=O)=O
Appearance: Solid powder
關(guān)鍵字： 732286-09-8;Lariatin A;
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