Chemical Compound

[(E,3R,4R,5S,6R,9S,10S)-4-acetyloxy-1-[formyl(methyl)amino]-11-[(10S,11R,13E,16S,20S,21R,22S,24E)-16-hydroxy-10,22-dimethoxy-11,21-dimethyl-12,18-dioxo-3,7,19,27-tetraoxa-29,30,31-triazatetracyclo[24.2.1.12,5.16,9]hentriaconta-1(28),2(31),4,6(30),8,13,24,26(29)-octaen-20-yl]-10-methoxy-3,5,9-trimethylundec-1-en-6-yl] (2R)-2,3-dimethoxypropanoate

CAS Registry Number 122752-21-0
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[(E,3R,4R,5S,6R,9S,10S)-4-acetyloxy-1-[formyl(methyl)amino]-11-[(10S,11R,13E,16S,20S,21R,22S,24E)-16-hydroxy-10,22-dimethoxy-11,21-dimethyl-12,18-dioxo-3,7,19,27-tetraoxa-29,30,31-triazatetracyclo[24.2.1.12,5.16,9]hentriaconta-1(28),2(31),4,6(30),8,13,24,26(29)-octaen-20-yl]-10-methoxy-3,5,9-trimethylundec-1-en-6-yl] (2R)-2,3-dimethoxypropanoate 结构式
Primary record

[(E,3R,4R,5S,6R,9S,10S)-4-acetyloxy-1-[formyl(methyl)amino]-11-[(10S,11R,13E,16S,20S,21R,22S,24E)-16-hydroxy-10,22-dimethoxy-11,21-dimethyl-12,18-dioxo-3,7,19,27-tetraoxa-29,30,31-triazatetracyclo[24.2.1.12,5.16,9]hentriaconta-1(28),2(31),4,6(30),8,13,24,26(29)-octaen-20-yl]-10-methoxy-3,5,9-trimethylundec-1-en-6-yl] (2R)-2,3-dimethoxypropanoate

库存
2,726 克
纯度
98.8 %
CAS
122752-21-0

化合物标识与属性

CAS
122752-21-0
PubChem CID
21775434
SMILES
C[C@@H]1[C@H](C/C=C/C2=NC(=CO2)C3=NC(=CO3)C4=NC(=CO4)[C@H]([C@H](C(=O)/C=C/C[C@@H](CC(=O)O[C@H]1C[C@@H]([C@@H](C)CC[C@H]([C@H](C)[C@@H]([C@H](C)/C=C/N(C)C=O)OC(=O)C)OC(=O)[C@@H](COC)OC)OC)O)C)OC)OC
Canonical SMILES
COC[C@@H](OC)C(=O)O[C@H](CC[C@H](C)[C@H](C[C@@H]1OC(=O)C[C@@H](O)C/C=C/C(=O)[C@H](C)[C@H](OC)c2coc(n2)-c2coc(n2)-c2coc(n2)/C=C/C[C@H](OC)[C@H]1C)OC)[C@H](C)[C@H](OC(C)=O)[C@H](C)/C=C/N(C)C=O

名称与同义词

  • mycalolide b
  • Mycalolide-B
  • RefChem:926283
  • CHEMBL4282474
  • DTXSID80893513
  • orb1691889
  • SCHEMBL20417338
  • DTXCID901323533
  • HY-N8493
  • BDBM50558159
  • C52-H74-N4-O17
  • 122752-21-0
  • CS-0144849
  • C16902
  • [(E,3R,4R,5S,6R,9S,10S)-4-acetyloxy-1-[formyl(methyl)amino]-11-[(10S,11R,13E,16S,20S,21R,22S,24E)-16-hydroxy-10,22-dimethoxy-11,21-dimethyl-12,18-dioxo-3,7,19,27-tetraoxa-29,30,31-triazatetracyclo[24.2.1.12,5.16,9]hentriaconta-1(28),2(31),4,6(30),8,13,24,26(29)-octaen-20-yl]-10-methoxy-3,5,9-trimethylundec-1-en-6-yl] (2R)-2,3-dimethoxypropanoate
  • ((E)-4-acetyloxy-1-(formyl(methyl)amino)-11-((13E,24E)-16-hydroxy-10,22-dimethoxy-11,21-dimethyl-12,18-dioxo-3,7,19,27-tetraoxa-29,30,31-triazatetracyclo(24.2.1.12,5.16,9)hentriaconta-1(28),2(31),4,6(30),8,13,24,26(29)-octaen-20-yl)-10-methoxy-3,5,9-trimethylundec-1-en-6-yl) 2,3-dimethoxypropanoate
  • ((E,3R,4R,5S,6R,9S,10S)-4-acetyloxy-1-(formyl(methyl)amino)-11-((10S,11R,13E,16S,20S,21R,22S,24E)-16-hydroxy-10,22-dimethoxy-11,21-dimethyl-12,18-dioxo-3,7,19,27-tetraoxa-29,30,31-triazatetracyclo(24.2.1.12,5.16,9)hentriaconta-1(28),2(31),4,6(30),8,13,24,26(29)-octaen-20-yl)-10-methoxy-3,5,9-trimethylundec-1-en-6-yl) (2R)-2,3-dimethoxypropanoate
  • ((E,3R,4R,5S,6R,9S,10S)-4-acetyloxy-1-(formyl(methyl)amino)-11-((10S,11R,13E,16S,20S,21R,22S,24Z)-16-hydroxy-10,22-dimethoxy-11,21-dimethyl-12,18-dioxo-3,7,19,27-tetraoxa-29,30,31-triazatetracyclo(24.2.1.12,5.16,9)hentriaconta-1(28),2(31),4,6(30),8,13,24,26(29)-octaen-20-yl)-10-methoxy-3,5,9-trimethylundec-1-en-6-yl) (2R)-2,3-dimethoxypropanoate
  • (1E,3R,4R,5S,6R,9S,10S)-4-(Acetyloxy)-11-[(4E,7S,8R,9S,13S,15E,18R,19S)-13-hydroxy-7,19-dimethoxy-8,18-dimethyl-11,17-dioxo-10-oxa-1(2,4),2,3(4,2)-tri([1,3]oxazola)cyclononadecaphane-4,15-dien-9-yl]-10-methoxy-3,5,9-trimethyl-1-(N-methylformamido)undec-1-en-6-yl (2R)-2,3-dimethoxypropanoate
  • 4-O-Acetyl-21-O-de(aminocarbonyl)-23,24-didehydro-39,46-dinor-6-deoxo-25-deoxy-6-(2,3-dimethoxy-1-oxopropoxy)-25-oxokabiramide C
  • Kabiramide C, 4-O-acetyl-21-O-de(aminocarbonyl)-23,24-didehydro-23-demethyl-4-O-demethyl-6-deoxo-25-deoxy-6-(2,3-dimethoxy-1-oxopropoxy)-25-oxo-