Chebi:142148

Structural Information

Molecular Formula

C₆₅H₁₁₃N₃O₃₇

SMILES

CCCCCCCCCCCCC/C=C/[C@H]([C@H](CO[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[C@H]3[C@@H]([C@H]([C@H]([C@H](O3)CO)O)O[C@H]4[C@@H]([C@H]([C@H]([C@H](O4)CO)O)O[C@@H]5[C@@H]([C@H]([C@H]([C@H](O5)CO)O)O[C@H]6[C@@H]([C@H]([C@H]([C@H](O6)CO)O)O)NC(=O)C)O)O[C@H]7[C@H]([C@@H]([C@@H]([C@@H](O7)C)O)O)O)NC(=O)C)O)O)O)O)NC=O)O

InChI

InChI=1S/C65H113N3O37/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-31(78)30(66-26-75)25-92-61-50(89)47(86)54(36(23-73)98-61)101-63-51(90)48(87)53(37(24-74)99-63)100-60-39(68-29(4)77)55(42(81)33(20-70)95-60)102-65-58(105-62-49(88)46(85)40(79)27(2)93-62)57(44(83)35(22-72)97-65)104-64-52(91)56(43(82)34(21-71)96-64)103-59-38(67-28(3)76)45(84)41(80)32(19-69)94-59/h17-18,26-27,30-65,69-74,78-91H,5-16,19-25H2,1-4H3,(H,66,75)(H,67,76)(H,68,77)/b18-17+/t27-,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-,60-,61+,62-,63-,64+,65-/m0/s1

InChIKey

JPURFQYCNHXNLL-FJSWAUFYSA-N

Compound name

N-[(2S,3R,4R,5R,6R)-2-[(2R,3R,4S,5S,6R)-2-[(2R,3R,4S,5S,6R)-2-[(2S,3R,4R,5R,6R)-3-acetamido-2-[(2R,3R,4R,5R,6S)-6-[(2R,3S,4R,5R,6R)-6-[(E,2S,3R)-2-formamido-3-hydroxyoctadec-4-enoxy]-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-5-hydroxy-6-(hydroxymethyl)-3-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-4-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide

Related CIDs

• CID 172429270