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(2S)-2-[[(2S)-3-[(2S,3R,4R,5S,6R)-3-acetamido-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-4-oxidanyl-oxan-2-yl]oxy-2-[[(2S)-2-[[(2S)-2-[[(2S)-3-[(2S,3R,4R,5S,6R)-3-acetamido-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-4-oxidanyl-oxan-2-yl]oxy-2-[[(2S)-2-azanylpropanoyl]amino]butanoyl]amino]propanoyl]amino]propanoyl]amino]butanoyl]amino]propanoic acid

Systemtic Name:	(2S)-2-[[(2S)-3-[(2S,3R,4R,5S,6R)-3-acetamido-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-4-oxidanyl-oxan-2-yl]oxy-2-[[(2S)-2-[[(2S)-2-[[(2S)-3-[(2S,3R,4R,5S,6R)-3-acetamido-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-4-oxidanyl-oxan-2-yl]oxy-2-[[(2S)-2-azanylpropanoyl]amino]butanoyl]amino]propanoyl]amino]propanoyl]amino]butanoyl]amino]propanoic acid
Openeye Name:	(2S)-2-[[(2S)-3-[(2S,3R,4R,5S,6R)-3-acetamido-4-hydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-2-[[(2S)-2-[[(2S)-2-[[(2S)-3-[(2S,3R,4R,5S,6R)-3-acetamido-4-hydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-2-[[(2S)-2-aminopropanoyl]amino]butanoyl]amino]propanoyl]amino]propanoyl]amino]butanoyl]amino]propanoic acid
CAS Name:	(2S)-2-[[(2S)-3-[[(2S,3R,4R,5S,6R)-3-acetamido-4-hydroxy-6-(hydroxymethyl)-5-[[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-2-oxanyl]oxy]-2-[[(2S)-2-[[(2S)-2-[[(2S)-3-[[(2S,3R,4R,5S,6R)-3-acetamido-4-hydroxy-6-(hydroxymethyl)-5-[[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-2-oxanyl]oxy]-2-[[(2S)-2-amino-1-oxopropyl]amino]-1-oxobutyl]amino]-1-oxopropyl]amino]-1-oxopropyl]amino]-1-oxobutyl]amino]propanoic acid
IUPAC Name:	(2S)-2-[[(2S)-3-[(2S,3R,4R,5S,6R)-3-acetamido-4-hydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2-[[(2S)-2-[[(2S)-2-[[(2S)-3-[(2S,3R,4R,5S,6R)-3-acetamido-4-hydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2-[[(2S)-2-aminopropanoyl]amino]butanoyl]amino]propanoyl]amino]propanoyl]amino]butanoyl]amino]propanoic acid
Traditional Name:	(2S)-2-[[(2S)-3-[(2S,3R,4R,5S,6R)-3-acetamido-4-hydroxy-6-methylol-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-2-[[(2S)-2-[[(2S)-2-[[(2S)-3-[(2S,3R,4R,5S,6R)-3-acetamido-4-hydroxy-6-methylol-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-2-[[(2S)-2-aminopropanoyl]amino]butanoyl]amino]propanoyl]amino]propanoyl]amino]butanoyl]amino]propionic acid
Formula:	C₄₈H₈₂N₈O₂₉
MolecularWeight:	1235.20088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)NC(C)C(=O)NC(C)C(=O)NC(C(C)OC1C(C(C(C(O1)CO)OC2C(C(C(C(O2)CO)O)O)O)O)NC(=O)C)C(=O)NC(C)C(=O)O)NC(=O)C(C)N)OC3C(C(C(C(O3)CO)OC4C(C(C(C(O4)CO)O)O)O)O)NC(=O)C

Isomeric SMILES

C[C@@H](C(=O)N[C@@H](C(C)O[C@@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O)O)O)NC(=O)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O[C@H]4[C@@H]([C@H]([C@H]([C@H](O4)CO)O)O)O)O)NC(=O)C)C(=O)N[C@@H](C)C(=O)O)N

InChI

InChI=1S/C48H82N8O29/c1-13(49)39(71)55-25(17(5)78-45-27(53-19(7)61)31(65)37(23(11-59)82-45)84-47-35(69)33(67)29(63)21(9-57)80-47)42(74)51-14(2)40(72)50-15(3)41(73)56-26(43(75)52-16(4)44(76)77)18(6)79-46-28(54-20(8)62)32(66)38(24(12-60)83-46)85-48-36(70)34(68)30(64)22(10-58)81-48/h13-18,21-38,45-48,57-60,63-70H,9-12,49H2,1-8H3,(H,50,72)(H,51,74)(H,52,75)(H,53,61)(H,54,62)(H,55,71)(H,56,73)(H,76,77)/t13-,14-,15-,16-,17?,18?,21+,22+,23+,24+,25-,26-,27+,28+,29-,30-,31+,32+,33-,34-,35+,36+,37+,38+,45-,46-,47-,48-/m0/s1

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