methyl 6-[(2R,3R,4R,5S,6S)-4-[(2R,3R,4R,5S,6R)-3-acetamido-4-[(2S,3R,4S,5R,6R)-3-[(2S,3R,4R,5S,6S)-4-[(2S,3R,4R,5S,6S)-4-[(2R,3R,4R,5S,6R)-3-acetamido-6-(hydroxymethyl)-4-[(2S,3R,4S,5R,6R)-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-6-methyl-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-4,5-bis(oxidanyl)oxan-2-yl]oxy-5-oxidanyl-oxan-2-yl]oxy-6-methyl-3,5-bis(oxidanyl)oxan-2-yl]oxy-6-methyl-3,5-bis(oxidanyl)oxan-2-yl]oxy-6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-2-yl]oxy-6-(hydroxymethyl)-5-oxidanyl-oxan-2-yl]oxy-6-methyl-3,5-b

Systemtic Name: methyl 6-[(2R,3R,4R,5S,6S)-4-[(2R,3R,4R,5S,6R)-3-acetamido-4-[(2S,3R,4S,5R,6R)-3-[(2S,3R,4R,5S,6S)-4-[(2S,3R,4R,5S,6S)-4-[(2R,3R,4R,5S,6R)-3-acetamido-6-(hydroxymethyl)-4-[(2S,3R,4S,5R,6R)-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-6-methyl-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-4,5-bis(oxidanyl)oxan-2-yl]oxy-5-oxidanyl-oxan-2-yl]oxy-6-methyl-3,5-bis(oxidanyl)oxan-2-yl]oxy-6-methyl-3,5-bis(oxidanyl)oxan-2-yl]oxy-6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-2-yl]oxy-6-(hydroxymethyl)-5-oxidanyl-oxan-2-yl]oxy-6-methyl-3,5-b Openeye Name: methyl 6-[(2R,3R,4R,5S,6S)-4-[(2R,3R,4R,5S,6R)-3-acetamido-4-[(2S,3R,4S,5R,6R)-3-[(2S,3R,4R,5S,6S)-4-[(2S,3R,4R,5S,6S)-4-[(2R,3R,4R,5S,6R)-3-acetamido-4-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-3,5-dihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-3,5-dihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-5-hydroxy CAS Name: 6-[[(2R,3R,4R,5S,6S)-4-[[(2R,3R,4R,5S,6R)-3-acetamido-4-[[(2S,3R,4S,5R,6R)-3-[[(2S,3R,4R,5S,6S)-4-[[(2S,3R,4R,5S,6S)-4-[[(2R,3R,4R,5S,6R)-3-acetamido-4-[[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-2-oxanyl]oxy]-2-oxanyl]oxy]-5-hydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-3,5-dihydroxy-6-methyl-2-oxanyl]oxy]-3,5-dihydroxy-6-methyl-2-oxanyl]oxy]-4,5-dihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-5-hydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-3,5-dihydroxy-6-methyl-2-oxany IUPAC Name: methyl 6-[(2R,3R,4R,5S,6S)-4-[(2R,3R,4R,5S,6R)-3-acetamido-4-[(2S,3R,4S,5R,6R)-3-[(2S,3R,4R,5S,6S)-4-[(2S,3R,4R,5S,6S)-4-[(2R,3R,4R,5S,6R)-3-acetamido-4-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,5-dihydroxy-6-methyloxan-2-yl]oxy-3,5-dihydroxy-6-methyloxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,5-dihydroxy-6-methyloxan-2-yl]oxyhex Traditional Name: 6-[(2R,3R,4R,5S,6S)-4-[(2R,3R,4R,5S,6R)-3-acetamido-4-[(2S,3R,4S,5R,6R)-3-[(2S,3R,4R,5S,6S)-4-[(2S,3R,4R,5S,6S)-4-[(2R,3R,4R,5S,6R)-3-acetamido-4-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-methylol-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-5-hydroxy-6-methylol-tetrahydropyran-2-yl]oxy-3,5-dihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-3,5-dihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-4,5-dihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-5-hydroxy-6-methylol-tetrahydropyra Formula: C59H100N2O39 MolecularWeight: 1461.4153

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(O1)OC2C(C(C(OC2OC3C(C(OC(C3O)CO)OC4C(C(OC(C4O)OC5C(C(OC(C5O)OC6C(C(C(OC6OC7C(C(OC(C7O)CO)OC8C(C(OC(C8O)OCCCCCC(=O)OC)C)O)NC(=O)C)CO)O)O)C)O)C)O)NC(=O)C)CO)O)O)O)O)O

Isomeric SMILES

C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@H]([C@H](O[C@@H]2O[C@@H]3[C@H]([C@H](O[C@@H]([C@H]3O)CO)O[C@@H]4[C@H]([C@@H](O[C@H]([C@@H]4O)O[C@@H]5[C@H]([C@@H](O[C@H]([C@@H]5O)O[C@@H]6[C@H]([C@H]([C@H](O[C@@H]6O[C@@H]7[C@H]([C@H](O[C@@H]([C@H]7O)CO)O[C@@H]8[C@H]([C@@H](O[C@H]([C@@H]8O)OCCCCCC(=O)OC)C)O)NC(=O)C)CO)O)O)C)O)C)O)NC(=O)C)CO)O)O)O)O)O

InChI

InChI=1S/C59H100N2O39/c1-17-30(69)38(77)41(80)55(87-17)99-50-39(78)34(73)23(13-62)92-58(50)94-46-29(61-22(6)67)53(91-26(16-65)37(46)76)97-48-32(71)19(3)88-56(43(48)82)98-49-33(72)20(4)89-57(44(49)83)100-51-40(79)35(74)24(14-63)93-59(51)95-45-28(60-21(5)66)52(90-25(15-64)36(45)75)96-47-31(70)18(2)86-54(42(47)81)85-12-10-8-9-11-27(68)84-7/h17-20,23-26,28-59,62-65,69-83H,8-16H2,1-7H3,(H,60,66)(H,61,67)/t17-,18-,19-,20-,23+,24+,25+,26+,28+,29+,30-,31-,32-,33-,34-,35-,36+,37+,38+,39-,40-,41+,42+,43+,44+,45+,46+,47+,48+,49+,50+,51+,52+,53+,54+,55-,56-,57-,58+,59+/m0/s1