Chemical Compound

64-[(6-carboxy-3-dodecanamido-4,5-dihydroxyoxan-2-yl)oxy]-43,63,65-trichloro-2,26,31,47,49-pentahydroxy-22-(methylamino)-21,35,38,54,56,59-hexaoxo-44-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-7,13,28-trioxa-20,36,39,53,55,58-hexaazaundecacyclo[38.14.2.23,6.214,17.219,34.18,12.123,27.129,33.141,45.010,37.046,51]hexahexaconta-3,5,8,10,12(64),14,16,23,25,27(61),29,31,33(60),41,43,45(57),46,48,50,62,65-henicosaene-52-carboxylic acid

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64-[(6-carboxy-3-dodecanamido-4,5-dihydroxyoxan-2-yl)oxy]-43,63,65-trichloro-2,26,31,47,49-pentahydroxy-22-(methylamino)-21,35,38,54,56,59-hexaoxo-44-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-7,13,28-trioxa-20,36,39,53,55,58-hexaazaundecacyclo[38.14.2.23,6.214,17.219,34.18,12.123,27.129,33.141,45.010,37.046,51]hexahexaconta-3,5,8,10,12(64),14,16,23,25,27(61),29,31,33(60),41,43,45(57),46,48,50,62,65-henicosaene-52-carboxylic acid 结构式
Primary record

64-[(6-carboxy-3-dodecanamido-4,5-dihydroxyoxan-2-yl)oxy]-43,63,65-trichloro-2,26,31,47,49-pentahydroxy-22-(methylamino)-21,35,38,54,56,59-hexaoxo-44-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-7,13,28-trioxa-20,36,39,53,55,58-hexaazaundecacyclo[38.14.2.23,6.214,17.219,34.18,12.123,27.129,33.141,45.010,37.046,51]hexahexaconta-3,5,8,10,12(64),14,16,23,25,27(61),29,31,33(60),41,43,45(57),46,48,50,62,65-henicosaene-52-carboxylic acid

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
177517233
SMILES
CCCCCCCCCCCC(=O)NC1C(C(C(OC1OC2=C3C=C4C=C2OC5=C(C=C(C=C5)C(C6C(=O)NC(C7=C(C(=CC(=C7)O)O)C8=C(C(=CC(=C8)C(C(=O)N6)NC(=O)C4NC(=O)C9C1=CC(=CC(=C1)OC1=C(C=CC(=C1)C(C(=O)NC(CC1=CC(=C(O3)C=C1)Cl)C(=O)N9)NC)O)O)Cl)OC1C(C(C(C(O1)CO)O)O)O)C(=O)O)O)Cl)C(=O)O)O)O
Canonical SMILES
CCCCCCCCCCCC(=O)NC1C(Oc2c3cc4cc2Oc2ccc(cc2Cl)C(O)C2NC(=O)C(NC(=O)C4NC(=O)C4NC(=O)C(Cc5ccc(c(Cl)c5)O3)NC(=O)C(NC)c3ccc(O)c(c3)Oc3cc(O)cc4c3)c3cc(Cl)c(OC4OC(CO)C(O)C(O)C4O)c(c3)-c3c(O)cc(O)cc3C(C(=O)O)NC2=O)OC(C(=O)O)C(O)C1O

名称与同义词

  • J2.862.453K
  • 15-N-Methyl-22,31,45-trichloro-7,64-O-didemethyl-19-deoxy-56-O-[2-[(1-oxododecyl)amino]-2-deoxy-beta-D-glucopyranuronosyl]-44-O-(alpha-D-mannopyranosyl)ristomycin A aglycone
  • 64-[(6-carboxy-3-dodecanamido-4,5-dihydroxyoxan-2-yl)oxy]-43,63,65-trichloro-2,26,31,47,49-pentahydroxy-22-(methylamino)-21,35,38,54,56,59-hexaoxo-44-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-7,13,28-trioxa-20,36,39,53,55,58-hexaazaundecacyclo[38.14.2.23,6.214,17.219,34.18,12.123,27.129,33.141,45.010,37.046,51]hexahexaconta-3,5,8,10,12(64),14,16,23,25,27(61),29,31,33(60),41,43,45(57),46,48,50,62,65-henicosaene-52-carboxylic acid