Chemical Compound

prop-2-en-1-yl (1S,2R,18R,19R,22S,25R,28R,40S)-48-{[(2S,3R,4S,5R,6R)-6-(azidomethyl)-3,4,5-tris(benzoyloxy)oxan-2-yl]oxy}-2,18-bis[(tert-butyldimethylsilyl)oxy]-22-(carbamoylmethyl)-47,49-dichloro-19-[(2R)-4-methyl-2-{methyl[(prop-2-en-1-yloxy)carbonyl]amino}pentanamido]-20,23,26,42,44-pentaoxo-32,35,37-tris(prop-2-en-1-yloxy)-7,13-dioxa-21,24,27,41,43-pentaazaoctacyclo[26.14.2.23,6.214,17.18,12.129,33.010,25.034,39]pentaconta-3,5,8(48),9,11,14,16,29,31,33(45),34,36,38,46,49-pentadecaene-40-carboxylate

prop-2-en-1-yl (1S,2R,18R,19R,22S,25R,28R,40S)-48-{[(2S,3R,4S,5R,6R)-6-(azidomethyl)-3,4,5-tris(benzoyloxy)oxan-2-yl]oxy}-2,18-bis[(tert-butyldimethylsilyl)oxy]-22-(carbamoylmethyl)-47,49-dichloro-19-[(2R)-4-methyl-2-{methyl[(prop-2-en-1-yloxy)carbonyl]amino}pentanamido]-20,23,26,42,44-pentaoxo-32,35,37-tris(prop-2-en-1-yloxy)-7,13-dioxa-21,24,27,41,43-pentaazaoctacyclo[26.14.2.23,6.214,17.18,12.129,33.010,25.034,39]pentaconta-3,5,8(48),9,11,14,16,29,31,33(45),34,36,38,46,49-pentadecaene-40-carboxylate 结构式
Primary record

prop-2-en-1-yl (1S,2R,18R,19R,22S,25R,28R,40S)-48-{[(2S,3R,4S,5R,6R)-6-(azidomethyl)-3,4,5-tris(benzoyloxy)oxan-2-yl]oxy}-2,18-bis[(tert-butyldimethylsilyl)oxy]-22-(carbamoylmethyl)-47,49-dichloro-19-[(2R)-4-methyl-2-{methyl[(prop-2-en-1-yloxy)carbonyl]amino}pentanamido]-20,23,26,42,44-pentaoxo-32,35,37-tris(prop-2-en-1-yloxy)-7,13-dioxa-21,24,27,41,43-pentaazaoctacyclo[26.14.2.23,6.214,17.18,12.129,33.010,25.034,39]pentaconta-3,5,8(48),9,11,14,16,29,31,33(45),34,36,38,46,49-pentadecaene-40-carboxylate

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
177619649
SMILES
CC(C)C[C@H](C(=O)N[C@@H]1[C@@H](C2=CC(=C(C=C2)OC3=CC4=CC(=C3O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CN=[N+]=[N-])OC(=O)C6=CC=CC=C6)OC(=O)C7=CC=CC=C7)OC(=O)C8=CC=CC=C8)OC9=C(C=C(C=C9)[C@H]([C@H]2C(=O)N[C@@H](C3=C(C(=CC(=C3)OCC=C)OCC=C)C3=C(C=CC(=C3)[C@H](C(=O)N2)NC(=O)[C@@H]4NC(=O)[C@@H](NC1=O)CC(=O)N)OCC=C)C(=O)OCC=C)O[Si](C)(C)C(C)(C)C)Cl)Cl)O[Si](C)(C)C(C)(C)C)N(C)C(=O)OCC=C
Canonical SMILES
C=CCOC(=O)[C@H]1NC(=O)[C@H]2NC(=O)[C@H](NC(=O)[C@@H]3NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](NC(=O)[C@@H](CC(C)C)N(C)C(=O)OCC=C)[C@H](O[Si](C)(C)C(C)(C)C)c4ccc(c(Cl)c4)Oc4cc3cc(c4O[C@@H]3O[C@H](CN=[N+]=[N-])[C@@H](OC(=O)c4ccccc4)[C@H](OC(=O)c4ccccc4)[C@H]3OC(=O)c3ccccc3)Oc3ccc(cc3Cl)[C@H]2O[Si](C)(C)C(C)(C)C)c2ccc(OCC=C)c(c2)-c2c(OCC=C)cc(OCC=C)cc21

名称与同义词

  • J2.465.264E
  • 2 -O,3 -O,4 -O-Tribenzoyl-6 -azido-7-O,22-O-bis(tert-butyldimethylsilyl)-28-O,30-O,32-O-triallyl-56-(allyloxycarbonyl)-2 -O-des(3-amino-3-C-methyl-2,3,6-trideoxy-alpha-L-arabino-hexopyranosyl)-6 -deoxyvancomycin allyl ester
  • prop-2-en-1-yl (1S,2R,18R,19R,22S,25R,28R,40S)-48-{[(2S,3R,4S,5R,6R)-6-(azidomethyl)-3,4,5-tris(benzoyloxy)oxan-2-yl]oxy}-2,18-bis[(tert-butyldimethylsilyl)oxy]-22-(carbamoylmethyl)-47,49-dichloro-19-[(2R)-4-methyl-2-{methyl[(prop-2-en-1-yloxy)carbonyl]amino}pentanamido]-20,23,26,42,44-pentaoxo-32,35,37-tris(prop-2-en-1-yloxy)-7,13-dioxa-21,24,27,41,43-pentaazaoctacyclo[26.14.2.23,6.214,17.18,12.129,33.010,25.034,39]pentaconta-3,5,8(48),9,11,14,16,29,31,33(45),34,36,38,46,49-pentadecaene-40-carboxylate