Current position:Home >Product >

N-[(2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5R,6S)-5-acetamido-6-[(2R,3S,4R,5R,6S)-5-acetamido-4-oxidanyl-2-(phenylmethoxymethyl)-6-phenylsulfanyl-oxan-3-yl]oxy-4-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl]oxy-5-[(2S,3R,4R,5S,6R)-3-acetamido-5-[tert-butyl(dimethyl)silyl]oxy-4-phenylmethoxy-6-(phenylmethoxymethyl)oxan-2-yl]oxy-4-oxidanyl-6-(phenylmethoxymethyl)oxan-3-yl]ethanamide

Systemtic Name:	N-[(2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5R,6S)-5-acetamido-6-[(2R,3S,4R,5R,6S)-5-acetamido-4-oxidanyl-2-(phenylmethoxymethyl)-6-phenylsulfanyl-oxan-3-yl]oxy-4-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl]oxy-5-[(2S,3R,4R,5S,6R)-3-acetamido-5-[tert-butyl(dimethyl)silyl]oxy-4-phenylmethoxy-6-(phenylmethoxymethyl)oxan-2-yl]oxy-4-oxidanyl-6-(phenylmethoxymethyl)oxan-3-yl]ethanamide
Openeye Name:	N-[(2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5R,6S)-5-acetamido-6-[(2R,3S,4R,5R,6S)-5-acetamido-2-(benzyloxymethyl)-4-hydroxy-6-phenylsulfanyl-tetrahydropyran-3-yl]oxy-4-benzyloxy-2-(benzyloxymethyl)tetrahydropyran-3-yl]oxy-5-[(2S,3R,4R,5S,6R)-3-acetamido-4-benzyloxy-6-(benzyloxymethyl)-5-[tert-butyl(dimethyl)silyl]oxy-tetrahydropyran-2-yl]oxy-6-(benzyloxymethyl)-4-hydroxy-tetrahydropyran-3-yl]acetamide
CAS Name:	N-[(2S,3R,4R,5S,6R)-2-[[(2R,3S,4R,5R,6S)-5-acetamido-6-[[(2R,3S,4R,5R,6S)-5-acetamido-4-hydroxy-2-(phenylmethoxymethyl)-6-(phenylthio)-3-oxanyl]oxy]-4-phenylmethoxy-2-(phenylmethoxymethyl)-3-oxanyl]oxy]-5-[[(2S,3R,4R,5S,6R)-3-acetamido-5-[tert-butyl(dimethyl)silyl]oxy-4-phenylmethoxy-6-(phenylmethoxymethyl)-2-oxanyl]oxy]-4-hydroxy-6-(phenylmethoxymethyl)-3-oxanyl]acetamide
IUPAC Name:	N-[(2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5R,6S)-5-acetamido-6-[(2R,3S,4R,5R,6S)-5-acetamido-4-hydroxy-2-(phenylmethoxymethyl)-6-phenylsulfanyloxan-3-yl]oxy-4-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl]oxy-5-[(2S,3R,4R,5S,6R)-3-acetamido-5-[tert-butyl(dimethyl)silyl]oxy-4-phenylmethoxy-6-(phenylmethoxymethyl)oxan-2-yl]oxy-4-hydroxy-6-(phenylmethoxymethyl)oxan-3-yl]acetamide
Traditional Name:	N-[(2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5R,6S)-5-acetamido-6-[(2R,3S,4R,5R,6S)-5-acetamido-2-(benzoxymethyl)-4-hydroxy-6-(phenylthio)tetrahydropyran-3-yl]oxy-4-benzoxy-2-(benzoxymethyl)tetrahydropyran-3-yl]oxy-5-[(2S,3R,4R,5S,6R)-3-acetamido-4-benzoxy-6-(benzoxymethyl)-5-[tert-butyl(dimethyl)silyl]oxy-tetrahydropyran-2-yl]oxy-6-(benzoxymethyl)-4-hydroxy-tetrahydropyran-3-yl]acetamide
Formula:	C₈₆H₁₀₈N₄O₂₀SSi
MolecularWeight:	1577.94302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(C(C(OC1OC2C(OC(C(C2OCC3=CC=CC=C3)NC(=O)C)OC4C(OC(C(C4O)NC(=O)C)SC5=CC=CC=C5)COCC6=CC=CC=C6)COCC7=CC=CC=C7)COCC8=CC=CC=C8)OC9C(C(C(C(O9)COCC1=CC=CC=C1)O[Si](C)(C)C(C)(C)C)OCC1=CC=CC=C1)NC(=O)C)O

Isomeric SMILES

CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1O[C@@H]2[C@H](O[C@H]([C@@H]([C@H]2OCC3=CC=CC=C3)NC(=O)C)O[C@@H]4[C@H](O[C@H]([C@@H]([C@H]4O)NC(=O)C)SC5=CC=CC=C5)COCC6=CC=CC=C6)COCC7=CC=CC=C7)COCC8=CC=CC=C8)O[C@H]9[C@@H]([C@H]([C@@H]([C@H](O9)COCC1=CC=CC=C1)O[Si](C)(C)C(C)(C)C)OCC1=CC=CC=C1)NC(=O)C)O

InChI

InChI=1S/C86H108N4O20SSi/c1-55(91)87-70-74(95)76(107-84-73(90-58(4)94)81(102-50-64-41-27-15-28-42-64)79(110-112(8,9)86(5,6)7)69(105-84)54-100-48-62-37-23-13-24-38-62)66(51-97-45-59-31-17-10-18-32-59)103-82(70)109-78-68(53-99-47-61-35-21-12-22-36-61)104-83(72(89-57(3)93)80(78)101-49-63-39-25-14-26-40-63)108-77-67(52-98-46-60-33-19-11-20-34-60)106-85(71(75(77)96)88-56(2)92)111-65-43-29-16-30-44-65/h10-44,66-85,95-96H,45-54H2,1-9H3,(H,87,91)(H,88,92)(H,89,93)(H,90,94)/t66-,67-,68-,69-,70-,71-,72-,73-,74-,75-,76-,77-,78-,79-,80-,81-,82+,83+,84+,85+/m1/s1

Other Product