Chemical Compound

(2S,4R)-4-(((2-((1R,3R)-1-(acetyloxy)-3-((2S,3S)-N-((acetyloxy)methyl)-2-((hydroxy((2R)-1-methylpiperidin-2-yl)methylidene)amino)-3-methylpentanamido)-4-methylpentyl)-1,3-thiazol-4-yl)(hydroxy)methylidene)amino)-5-(4-hydroxyphenyl)-2-methylpentanoate

CAS Registry Number 799822-10-9
返回搜索 申请报价
(2S,4R)-4-(((2-((1R,3R)-1-(acetyloxy)-3-((2S,3S)-N-((acetyloxy)methyl)-2-((hydroxy((2R)-1-methylpiperidin-2-yl)methylidene)amino)-3-methylpentanamido)-4-methylpentyl)-1,3-thiazol-4-yl)(hydroxy)methylidene)amino)-5-(4-hydroxyphenyl)-2-methylpentanoate 结构式
Primary record

(2S,4R)-4-(((2-((1R,3R)-1-(acetyloxy)-3-((2S,3S)-N-((acetyloxy)methyl)-2-((hydroxy((2R)-1-methylpiperidin-2-yl)methylidene)amino)-3-methylpentanamido)-4-methylpentyl)-1,3-thiazol-4-yl)(hydroxy)methylidene)amino)-5-(4-hydroxyphenyl)-2-methylpentanoate

库存
3,732 克
纯度
99.5 %
CAS
799822-10-9

化合物标识与属性

CAS
799822-10-9
PubChem CID
11422937
SMILES
CC[C@H](C)[C@@H](C(=O)N(COC(=O)C)[C@H](C[C@H](C1=NC(=CS1)C(=O)N[C@@H](CC2=CC=C(C=C2)O)C[C@H](C)C(=O)O)OC(=O)C)C(C)C)NC(=O)[C@H]3CCCCN3C
Canonical SMILES
CC[C@H](C)[C@H](NC(=O)[C@H]1CCCCN1C)C(=O)N(COC(C)=O)[C@H](C[C@@H](OC(C)=O)c1nc(C(=O)N[C@@H](Cc2ccc(O)cc2)C[C@H](C)C(=O)O)cs1)C(C)C

名称与同义词

  • Tubulysin I
  • RefChem:192471
  • orb1989645
  • SCHEMBL29475220
  • EX-A5466J
  • CHEBI:218315
  • HY-N7052
  • AKOS040740947
  • CID11422937
  • 799822-10-9
  • CID 11422937
  • DA-78697
  • CS-0101871
  • J3.220.713H
  • (2S,4R)-4-[[2-[(1R,3R)-1-acetyloxy-3-[acetyloxymethyl-[(2S,3S)-3-methyl-2-[[(2R)-1-methylpiperidine-2-carbonyl]amino]pentanoyl]amino]-4-methylpentyl]-1,3-thiazole-4-carbonyl]amino]-5-(4-hydroxyphenyl)-2-methylpentanoic acid
  • (2S,4R)-4-(((2-((1R,3R)-1-(acetyloxy)-3-((2S,3S)-N-((acetyloxy)methyl)-2-((hydroxy((2R)-1-methylpiperidin-2-yl)methylidene)amino)-3-methylpentanamido)-4-methylpentyl)-1,3-thiazol-4-yl)(hydroxy)methylidene)amino)-5-(4-hydroxyphenyl)-2-methylpentanoate
  • (2S,4R)-4-((2-((1R,3R)-1-acetyloxy-3-(acetyloxymethyl-((2S,3S)-3-methyl-2-(((2R)-1-methylpiperidine-2-carbonyl)amino)pentanoyl)amino)-4-methylpentyl)-1,3-thiazole-4-carbonyl)amino)-5-(4-hydroxyphenyl)-2-methylpentanoic acid
  • (2S,4R)-4-({2-[(1R,3R)-1-(acetyloxy)-3-[(2S,3S)-N-[(acetyloxy)methyl]-3-methyl-2-{[(2R)-1-methylpiperidin-2-yl]formamido}pentanamido]-4-methylpentyl]-1,3-thiazol-4-yl}formamido)-5-(4-hydroxyphenyl)-2-methylpentanoic acid
  • (2S,4R)-4-[({2-[(1R,3R)-1-(acetyloxy)-3-[(2S,3S)-N-[(acetyloxy)methyl]-2-({hydroxy[(2R)-1-methylpiperidin-2-yl]methylidene}amino)-3-methylpentanamido]-4-methylpentyl]-1,3-thiazol-4-yl}(hydroxy)methylidene)amino]-5-(4-hydroxyphenyl)-2-methylpentanoate
  • (2S,4R)-4-[[[2-[(1R,3R)-3-[(Acetyloxymethyl)[N-[[(2R)-1-methylpiperidine-2-yl]carbonyl]-L-isoleucyl]amino]-1-(acetoxy)-3-isopropylpropyl]thiazole-4-yl]carbonyl]amino]-2-methyl-5-(4-hydroxyphenyl)pentanoic acid