Chemical Compound

2-((2-(((2-((18S,25S,32S,35S)-25-benzyl-35-((2S)-butan-2-yl)-16,23,30,33-tetrahydroxy-18-((C-hydroxycarbonimidoyl)methyl)-32-((4-hydroxyphenyl)methyl)-21-methyl-3,13,20,27,37-pentathia-7,17,24,31,34,39,40,41,42,43-decaazaheptacyclo(34.2.1.1,.1,.1,.1,.0,)tritetraconta-1(38),2(43),4,6(11),7,9,12(42),14,16,19(41),21,23,26(40),28,30,33,36(39)-heptadecaen-8-yl)-1,3-thiazol-4-yl)(hydroxy)methylidene)amino)-1-hydroxyprop-2-en-1-ylidene)amino)prop-2-enoate

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2-((2-(((2-((18S,25S,32S,35S)-25-benzyl-35-((2S)-butan-2-yl)-16,23,30,33-tetrahydroxy-18-((C-hydroxycarbonimidoyl)methyl)-32-((4-hydroxyphenyl)methyl)-21-methyl-3,13,20,27,37-pentathia-7,17,24,31,34,39,40,41,42,43-decaazaheptacyclo(34.2.1.1,.1,.1,.1,.0,)tritetraconta-1(38),2(43),4,6(11),7,9,12(42),14,16,19(41),21,23,26(40),28,30,33,36(39)-heptadecaen-8-yl)-1,3-thiazol-4-yl)(hydroxy)methylidene)amino)-1-hydroxyprop-2-en-1-ylidene)amino)prop-2-enoate 结构式
Primary record

2-((2-(((2-((18S,25S,32S,35S)-25-benzyl-35-((2S)-butan-2-yl)-16,23,30,33-tetrahydroxy-18-((C-hydroxycarbonimidoyl)methyl)-32-((4-hydroxyphenyl)methyl)-21-methyl-3,13,20,27,37-pentathia-7,17,24,31,34,39,40,41,42,43-decaazaheptacyclo(34.2.1.1,.1,.1,.1,.0,)tritetraconta-1(38),2(43),4,6(11),7,9,12(42),14,16,19(41),21,23,26(40),28,30,33,36(39)-heptadecaen-8-yl)-1,3-thiazol-4-yl)(hydroxy)methylidene)amino)-1-hydroxyprop-2-en-1-ylidene)amino)prop-2-enoate

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
42637059
SMILES
CC[C@H](C)[C@H]1C2=NC(=CS2)C3=NC(=CS3)C4=C(C=CC(=N4)C5=NC(=CS5)C(=O)NC(=C)C(=O)NC(=C)C(=O)O)C6=NC(=CS6)C(=O)N[C@H](C7=NC(=C(S7)C)C(=O)N[C@H](C8=NC(=CS8)C(=O)N[C@H](C(=O)N1)CC9=CC=C(C=C9)O)CC1=CC=CC=C1)CC(=O)N
Canonical SMILES
C=C(NC(=O)C(=C)NC(=O)c1csc(-c2ccc3c(n2)-c2csc(n2)-c2csc(n2)[C@H]([C@@H](C)CC)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)c2csc(n2)[C@H](Cc2ccccc2)NC(=O)c2nc(sc2C)[C@H](CC(N)=O)NC(=O)c2csc-3n2)n1)C(=O)O

名称与同义词

  • Thiomuracin D
  • RefChem:189572
  • CHEBI:197811
  • J2.716.688A
  • (10S,13S,20S,27S)-20-Benzyl-13-(4-hydroxybenzyl)-10-[(1S)-1-methylpropyl]-27-(carbamoylmethyl)-37-[4-[[1-[(1-carboxyethenyl)carbamoyl]ethenyl]carbamoyl]-2-thiazolyl]-24-methyl-2,5:6,9:16,19:23,26:30,33-pentaepinitrilo-4,8,18,25,32-pentathia-11,14,21,28,38-pentaazabicyclo[32.4.0]octatriacontane-1(34),2,6,16,23,30,35,37-octaene-12,15,22,29-tetraone
  • 2-((2-(((2-((18S,25S,32S,35S)-25-benzyl-35-((2S)-butan-2-yl)-16,23,30,33-tetrahydroxy-18-((C-hydroxycarbonimidoyl)methyl)-32-((4-hydroxyphenyl)methyl)-21-methyl-3,13,20,27,37-pentathia-7,17,24,31,34,39,40,41,42,43-decaazaheptacyclo(34.2.1.1,.1,.1,.1,.0,)tritetraconta-1(38),2(43),4,6(11),7,9,12(42),14,16,19(41),21,23,26(40),28,30,33,36(39)-heptadecaen-8-yl)-1,3-thiazol-4-yl)(hydroxy)methylidene)amino)-1-hydroxyprop-2-en-1-ylidene)amino)prop-2-enoate
  • 2-({2-[({2-[(18S,25S,32S,35S)-25-benzyl-35-[(2S)-butan-2-yl]-16,23,30,33-tetrahydroxy-18-[(C-hydroxycarbonimidoyl)methyl]-32-[(4-hydroxyphenyl)methyl]-21-methyl-3,13,20,27,37-pentathia-7,17,24,31,34,39,40,41,42,43-decaazaheptacyclo[34.2.1.1,.1,.1,.1,.0,]tritetraconta-1(38),2(43),4,6(11),7,9,12(42),14,16,19(41),21,23,26(40),28,30,33,36(39)-heptadecaen-8-yl]-1,3-thiazol-4-yl}(hydroxy)methylidene)amino]-1-hydroxyprop-2-en-1-ylidene}amino)prop-2-enoate
  • 2-[2-({2-[(18S,25S,32S,35S)-25-benzyl-35-[(2S)-butan-2-yl]-18-(carbamoylmethyl)-32-[(4-hydroxyphenyl)methyl]-21-methyl-16,23,30,33-tetraoxo-3,13,20,27,37-pentathia-7,17,24,31,34,39,40,41,42,43-decaazaheptacyclo[34.2.1.12,5.112,15.119,22.126,29.06,11]tritetraconta-1(38),2(43),4,6,8,10,12(42),14,19(41),21,26(40),28,36(39)-tridecaen-8-yl]-1,3-thiazol-4-yl}formamido)prop-2-enamido]prop-2-enoic acid
  • 2-[2-[[2-[(18S,25S,32S,35S)-18-(2-amino-2-oxoethyl)-25-benzyl-35-[(2S)-butan-2-yl]-32-[(4-hydroxyphenyl)methyl]-21-methyl-16,23,30,33-tetraoxo-3,13,20,27,37-pentathia-7,17,24,31,34,39,40,41,42,43-decazaheptacyclo[34.2.1.12,5.112,15.119,22.126,29.06,11]tritetraconta-1(38),2(43),4,6(11),7,9,12(42),14,19(41),21,26(40),28,36(39)-tridecaen-8-yl]-1,3-thiazole-4-carbonyl]amino]prop-2-enoylamino]prop-2-enoic acid