Chemical Compound

3-[(2-{7,17,24,31,34,39,40,41,42,43-Decaaza-35-(hydroxyphenylmethyl)-21-methyl-18-[(N-methylcarbamoyl)methyl]-25-(methylethyl)-16,23,30,33-tetraoxo-28-(pyrimidin-2-ylthiomethyl)-3,13,20,27,37-pentathiaheptacyclo[34.2.1.1<2,5>.1<12,15>.1<19,22>.1<26,29>.0<6,11>]tritetraconta-1(38),2(40),4,6,8,10,12(41),14,19(42),21,26(43),28,36(39)-tridecaen-8-yl}-1,3-thiazol-4-yl)carbonylamino]propanoic acid

3-[(2-{7,17,24,31,34,39,40,41,42,43-Decaaza-35-(hydroxyphenylmethyl)-21-methyl-18-[(N-methylcarbamoyl)methyl]-25-(methylethyl)-16,23,30,33-tetraoxo-28-(pyrimidin-2-ylthiomethyl)-3,13,20,27,37-pentathiaheptacyclo[34.2.1.1<2,5>.1<12,15>.1<19,22>.1<26,29>.0<6,11>]tritetraconta-1(38),2(40),4,6,8,10,12(41),14,19(42),21,26(43),28,36(39)-tridecaen-8-yl}-1,3-thiazol-4-yl)carbonylamino]propanoic acid 结构式
Primary record

3-[(2-{7,17,24,31,34,39,40,41,42,43-Decaaza-35-(hydroxyphenylmethyl)-21-methyl-18-[(N-methylcarbamoyl)methyl]-25-(methylethyl)-16,23,30,33-tetraoxo-28-(pyrimidin-2-ylthiomethyl)-3,13,20,27,37-pentathiaheptacyclo[34.2.1.1<2,5>.1<12,15>.1<19,22>.1<26,29>.0<6,11>]tritetraconta-1(38),2(40),4,6,8,10,12(41),14,19(42),21,26(43),28,36(39)-tridecaen-8-yl}-1,3-thiazol-4-yl)carbonylamino]propanoic acid

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
16130632
SMILES
CC1=C2C(=O)NC(C3=NC(=C(S3)CSC4=NC=CC=N4)C(=O)NCC(=O)NC(C5=NC(=CS5)C6=NC(=CS6)C7=C(C=CC(=N7)C8=NC(=CS8)C(=O)NCCC(=O)O)C9=NC(=CS9)C(=O)NC(C(=N2)S1)CC(=O)NC)C(C1=CC=CC=C1)O)C(C)C
Canonical SMILES
CNC(=O)CC1NC(=O)c2csc(n2)-c2ccc(-c3nc(C(=O)NCCC(=O)O)cs3)nc2-c2csc(n2)-c2csc(n2)C(C(O)c2ccccc2)NC(=O)CNC(=O)c2nc(sc2CSc2ncccn2)C(C(C)C)NC(=O)c2nc1sc2C

名称与同义词

  • GE2270A derivative
  • 3-[(2-{7,17,24,31,34,39,40,41,42,43-Decaaza-35-(hydroxyphenylmethyl)-21-methyl-18-[(N-methylcarbamoyl)methyl]-25-(methylethyl)-16,23,30,33-tetraoxo-28-(pyrimidin-2-ylthiomethyl)-3,13,20,27,37-pentathiaheptacyclo[34.2.1.1<2,5>.1<12,15>.1<19,22>.1<26,29>.0<6,11>]tritetraconta-1(38),2(40),4,6,8,10,12(41),14,19(42),21,26(43),28,36(39)-tridecaen-8-yl}-1,3-thiazol-4-yl)carbonylamino]propanoic acid
  • 3-[[2-[[hydroxy(phenyl)methyl]-isopropyl-methyl-[2-(methylamino)-2-oxo-ethyl]-tetraoxo-(pyrimidin-2-ylsulfanylmethyl)[?]yl]thiazole-4-carbonyl]amino]propanoic acid