Chemical Compound

(1S,2R,19R,22R,34S,37R,40R,52S)-22-Amino-48-({4-[(4-butylphenyl)methyl]piperazin-1-yl}methyl)-5,15-dichloro-N-[3-(dimethylamino)propyl]-2,26,31,44,47,49,64-heptahydroxy-21,35,38,54,56,59-hexaoxo-7,13,28-trioxa-20,36,39,53,55,58-hexaazaundecacyclo[38.14.2.2~3,6~.2~14,17~.2~19,34~.1~8,12~.1~23,27~.1~29,33~.1~41,45~.0~10,37~.0~46,51~]hexahexaconta-3,5,8(64),9,11,14,16,23(61),24,26,29(60),30,32,41(57),42,44,46,48,50,62,65-henicosaene-52-carboxamide

CAS Registry Number 562105-28-6
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(1S,2R,19R,22R,34S,37R,40R,52S)-22-Amino-48-({4-[(4-butylphenyl)methyl]piperazin-1-yl}methyl)-5,15-dichloro-N-[3-(dimethylamino)propyl]-2,26,31,44,47,49,64-heptahydroxy-21,35,38,54,56,59-hexaoxo-7,13,28-trioxa-20,36,39,53,55,58-hexaazaundecacyclo[38.14.2.2~3,6~.2~14,17~.2~19,34~.1~8,12~.1~23,27~.1~29,33~.1~41,45~.0~10,37~.0~46,51~]hexahexaconta-3,5,8(64),9,11,14,16,23(61),24,26,29(60),30,32,41(57),42,44,46,48,50,62,65-henicosaene-52-carboxamide 结构式
Primary record

(1S,2R,19R,22R,34S,37R,40R,52S)-22-Amino-48-({4-[(4-butylphenyl)methyl]piperazin-1-yl}methyl)-5,15-dichloro-N-[3-(dimethylamino)propyl]-2,26,31,44,47,49,64-heptahydroxy-21,35,38,54,56,59-hexaoxo-7,13,28-trioxa-20,36,39,53,55,58-hexaazaundecacyclo[38.14.2.2~3,6~.2~14,17~.2~19,34~.1~8,12~.1~23,27~.1~29,33~.1~41,45~.0~10,37~.0~46,51~]hexahexaconta-3,5,8(64),9,11,14,16,23(61),24,26,29(60),30,32,41(57),42,44,46,48,50,62,65-henicosaene-52-carboxamide

库存
3,412 克
纯度
99.0 %
CAS
562105-28-6

化合物标识与属性

CAS
562105-28-6
PubChem CID
16133952
SMILES
CCCCC1=CC=C(C=C1)CN2CCN(CC2)CC3=C(C=C4[C@H](NC(=O)[C@@H]5[C@@H](C6=CC(=C(C=C6)OC7=CC8=CC(=C7O)OC9=C(C=C(C[C@@H]1C(=O)N[C@@H](C2=CC(=CC(=C2)OC2=C(C=CC(=C2)[C@H](C(=O)N1)N)O)O)C(=O)N[C@H]8C(=O)N[C@H](C1=CC(=C(C=C1)O)C4=C3O)C(=O)N5)C=C9)Cl)Cl)O)C(=O)NCCCN(C)C)O
Canonical SMILES
CCCCc1ccc(CN2CCN(Cc3c(O)cc4c(c3O)-c3cc(ccc3O)[C@H]3NC(=O)[C@@H]5NC(=O)[C@H]6NC(=O)[C@@H](Cc7ccc(c(Cl)c7)Oc7cc5cc(c7O)Oc5ccc(cc5Cl)[C@@H](O)[C@H](NC3=O)C(=O)N[C@@H]4C(=O)NCCCN(C)C)NC(=O)[C@H](N)c3ccc(O)c(c3)Oc3cc(O)cc6c3)CC2)cc1

名称与同义词

  • DTXSID30204756
  • 562105-28-6
  • Ristomycin A aglycone, 41-((4-((4-butylphenyl)-1-piperazinyl)methyl)-22, 31-dichloro-38-de(methoxycarbonyl)-7-demethyl-19-deoxy-38-(((3-(dimethylamino)propyl)amino)carbonyl)-
  • (1S,2R,19R,22R,34S,37R,40R,52S)-22-Amino-48-({4-[(4-butylphenyl)methyl]piperazin-1-yl}methyl)-5,15-dichloro-N-[3-(dimethylamino)propyl]-2,26,31,44,47,49,64-heptahydroxy-21,35,38,54,56,59-hexaoxo-7,13,28-trioxa-20,36,39,53,55,58-hexaazaundecacyclo[38.14.2.2~3,6~.2~14,17~.2~19,34~.1~8,12~.1~23,27~.1~29,33~.1~41,45~.0~10,37~.0~46,51~]hexahexaconta-3,5,8(64),9,11,14,16,23(61),24,26,29(60),30,32,41(57),42,44,46,48,50,62,65-henicosaene-52-carboxamide
  • amino-[[4-[(4-butylphenyl)methyl]piperazin-1-yl]methyl]-dichloro-N-[3-(dimethylamino)propyl]-heptahydroxy-hexaoxo-[?]carboxamide
  • Ristomycin A aglycone, 41-[[4-[(4-butylphenyl]-1-piperazinyl]methyl]-22, 31-dichloro-38-de(methoxycarbonyl)-7-demethyl-19-deoxy-38-[[[3-(dimethylamino)propyl]amino]carbonyl]-
  • Teicoplanin aglycon, 38-N-(dimethylamino propyl)carbamyl-, 41-(1-(4-butylbenzyl)-4-piperazinyl)methyl-
  • Teicoplanin aglycon, 38-N-(dimethylamino propyl)carbamyl-, 41-[1-(4-butyl benzyl)-4-piperazinyl]methyl-