Chemical Compound

(2R,3S,4S,5R,6R)-2-{[(2R,3S,4S,5S,6S)-2-[(1R,2S)-2-({6-Amino-2-[(1S)-3-amino-1-{[(2S)-2,3-diamino-3-oxopropyl]amino}-3-oxopropyl]-5-methylpyrimidine-4-carbonyl}amino)-3-{[(2R,3S)-5-({(2S,3R)-1-[(2-{4-[(4-aminobutyl)carbamoyl][2,4'-bi-1,3-thiazol]-2'-yl}-1-{[(2S,3R,4R,5S,6S)-5-amino-3,4-dihydroxy-6-methyloxan-2-yl]oxy}-2-hydroxyethyl)amino]-3-hydroxy-1-oxobutan-2-yl}amino)-3-hydroxy-5-oxopentan-2-yl]amino}-1-(1H-imidazol-5-yl)-3-oxopropoxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl carbamate

CAS Registry Number 76069-32-4
(2R,3S,4S,5R,6R)-2-{[(2R,3S,4S,5S,6S)-2-[(1R,2S)-2-({6-Amino-2-[(1S)-3-amino-1-{[(2S)-2,3-diamino-3-oxopropyl]amino}-3-oxopropyl]-5-methylpyrimidine-4-carbonyl}amino)-3-{[(2R,3S)-5-({(2S,3R)-1-[(2-{4-[(4-aminobutyl)carbamoyl][2,4'-bi-1,3-thiazol]-2'-yl}-1-{[(2S,3R,4R,5S,6S)-5-amino-3,4-dihydroxy-6-methyloxan-2-yl]oxy}-2-hydroxyethyl)amino]-3-hydroxy-1-oxobutan-2-yl}amino)-3-hydroxy-5-oxopentan-2-yl]amino}-1-(1H-imidazol-5-yl)-3-oxopropoxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl carbamate 结构式
Primary record

(2R,3S,4S,5R,6R)-2-{[(2R,3S,4S,5S,6S)-2-[(1R,2S)-2-({6-Amino-2-[(1S)-3-amino-1-{[(2S)-2,3-diamino-3-oxopropyl]amino}-3-oxopropyl]-5-methylpyrimidine-4-carbonyl}amino)-3-{[(2R,3S)-5-({(2S,3R)-1-[(2-{4-[(4-aminobutyl)carbamoyl][2,4'-bi-1,3-thiazol]-2'-yl}-1-{[(2S,3R,4R,5S,6S)-5-amino-3,4-dihydroxy-6-methyloxan-2-yl]oxy}-2-hydroxyethyl)amino]-3-hydroxy-1-oxobutan-2-yl}amino)-3-hydroxy-5-oxopentan-2-yl]amino}-1-(1H-imidazol-5-yl)-3-oxopropoxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl carbamate

库存
7,432 克
纯度
98.7 %
CAS
76069-32-4

化合物标识与属性

CAS
76069-32-4
PubChem CID
70697950
SMILES
C[C@H]1[C@H]([C@H]([C@H]([C@@H](O1)OC(C(C2=NC(=CS2)C3=NC(=CS3)C(=O)NCCCCN)O)NC(=O)[C@H]([C@@H](C)O)NC(=O)C[C@@H]([C@@H](C)NC(=O)[C@H]([C@H](C4=CN=CN4)O[C@H]5[C@H]([C@H]([C@@H]([C@@H](O5)CO)O)O)O[C@@H]6[C@H]([C@H]([C@@H]([C@H](O6)CO)O)OC(=O)N)O)NC(=O)C7=C(C(=NC(=N7)[C@H](CC(=O)N)NC[C@@H](C(=O)N)N)N)C)O)O)O)N
Canonical SMILES
Cc1c(N)nc([C@H](CC(N)=O)NC[C@H](N)C(N)=O)nc1C(=O)N[C@H](C(=O)N[C@H](C)[C@@H](O)CC(=O)N[C@H](C(=O)NC(O[C@@H]1O[C@@H](C)[C@@H](N)[C@@H](O)[C@H]1O)C(O)c1nc(-c2nc(C(=O)NCCCCN)cs2)cs1)[C@@H](C)O)[C@@H](O[C@@H]1O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]1O[C@H]1O[C@H](CO)[C@@H](O)[C@H](OC(N)=O)[C@@H]1O)c1cnc[nH]1

名称与同义词

  • Talisomycin S10b
  • TALLYSOMYCIN S10B
  • RefChem:187316
  • Talisomycin S(sub 10b)
  • Tallysomycin S(sub 10b)
  • CHEMBL3391937
  • SCHEMBL29409432
  • CHEBI:67810
  • DTXSID801316569
  • C59H91N19O26S2
  • BRN 4325250
  • J71.196I
  • C59-H91-N19-O26-S2
  • Q27136287
  • 76069-32-4
  • (2R,3S,4S,5R,6R)-2-{[(2R,3S,4S,5S,6S)-2-[(1R,2S)-2-({6-amino-2-[(1S)-1-{[(2S)-2-amino-2-carbamoylethyl]amino}-2-carbamoylethyl]-5-methylpyrimidin-4-yl}formamido)-2-{[(2R,3S)-4-{[(1S,2R)-1-[(1-{[(2S,3R,4R,5S,6S)-5-amino-3,4-dihydroxy-6-methyloxan-2-yl]oxy}-2-(4-{4-[(4-aminobutyl)carbamoyl]-1,3-thiazol-2-yl}-1,3-thiazol-2-yl)-2-hydroxyethyl)carbamoyl]-2-hydroxypropyl]carbamoyl}-3-hydroxybutan-2-yl]carbamoyl}-1-(1H-imidazol-4-yl)ethoxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl carbamate
  • (2R,3S,4S,5R,6R)-2-{[(2R,3S,4S,5S,6S)-2-[(1R,2S)-2-({6-Amino-2-[(1S)-3-amino-1-{[(2S)-2,3-diamino-3-oxopropyl]amino}-3-oxopropyl]-5-methylpyrimidine-4-carbonyl}amino)-3-{[(2R,3S)-5-({(2S,3R)-1-[(2-{4-[(4-aminobutyl)carbamoyl][2,4'-bi-1,3-thiazol]-2'-yl}-1-{[(2S,3R,4R,5S,6S)-5-amino-3,4-dihydroxy-6-methyloxan-2-yl]oxy}-2-hydroxyethyl)amino]-3-hydroxy-1-oxobutan-2-yl}amino)-3-hydroxy-5-oxopentan-2-yl]amino}-1-(1H-imidazol-5-yl)-3-oxopropoxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl carbamate
  • N1-(4-Aminobutyl)-13-[(4-amino-4,6-dideoxy-alpha-L-talopyranosyl)oxy]-19-demethyl-12-hydroxybleomycinamide