Try beta.chemspider
- 32 of 35 defined stereocentres
(2S,3R)-3-Hydroxy-2-(icosanoylamino)octadecyl 5-acetamido-6-[(1S,2R)-2-({5-acetamido-6-[(1S,2R)-2-({5-acetamido-3,5-dideoxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]-beta-L-threo-hex-2-ulopyranonosyl}oxy)-1, 3-dihydroxypropyl]-3,5-dideoxy-beta-L-threo-hex-2-ulopyranonosyl}oxy)-1,3-dihydroxypropyl]-3,5-dideoxy-beta-L-threo-hex-2-ulopyranonosyl-(2->3)-[2-deoxy-2-(2-oxopropyl)-beta-D-galactopyranosyl-(1->4)] -beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside
CCCCCCCCCCCCCCCCCCCC(=O)N[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)CC(=O)C)O[C@@]4(C[C@@H]([C@H](C(O4)[C@@H]([C@@H](CO)O[C@@]5(C[C@@H]([C@H](C(O5)[C@@H]([C@@H](CO)O[C@@]6(C[C@@H]([C@H](C(O6)[C@@H]([C@@H](CO)O)O)NC(=O)C)O)C(=O)O)O)NC(=O)C)O)C(=O)O)O)NC(=O)C)O)C(=O)O)O)O)O)[C@@H](CCCCCCCCCCCCCCC)O
InChI=1S/C92H162N4O42/c1-7-9-11-13-15-17-19-21-22-23-24-26-28-30-32-34-36-38-66(112)96-55(56(107)37-35-33-31-29-27-25-20-18-16-14-12-10-8-2)49-127-85-76(119)75(118)78(64(47-101)129-85)131-86-77(120)83(79(65(48-102)130-86)132-84-54(39-50(3)103)70(113)72(115)61(44-98)128-84)138-92(89(125)126)42-59(110)69(95-53(6)106)82(137-92)74(117)63(46-100)134-91(88(123)124)41-58(109)68(94-52(5)105)81(136-91)73(116)62(45-99)133-90(87(121)122)40-57(108)67(93-51(4)104)80(135-90)71(114)60(111)43-97/h54-65,67-86,97-102,107-111,113-120H,7-49H2,1-6H3,(H,93,104)(H,94,105)(H,95,106)(H,96,112)(H,121,122)(H,123,124)(H,125,126)/t54-,55+,56-,57+,58+,59+,60-,61-,62-,63-,64-,65-,67-,68-,69-,70-,71-,72+,73-,74-,75-,76-,77-,78-,79+,80?,81?,82?,83-,84+,85-,86+,90-,91-,92+/m1/s1
MIOYXQUDLLYMSX-UARLSFGXSA-N
CSID:35032343, http://www.chemspider.com/Chemical-Structure.35032343.html (accessed 17:49, Apr 27, 2024)
Validated by Experts, Validated by Users, Non-Validated, Removed by Users
Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00
Click to predict properties on the Chemicalize site
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