Try beta.chemspider
- Double-bond stereo
- 32 of 35 defined stereocentres
(2S,3R,4E)-3-Hydroxy-2-(palmitoylamino)-4-octadecen-1-yl 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-ulopyranono syl}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-galactopyrano syl-(1->4)]-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside
CCCCCCCCCCCCCCCC(=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](/C=C/CCCCCCCCCCCCC)O
InChI=1S/C88H152N4O42/c1-7-9-11-13-15-17-19-21-23-25-27-29-31-33-52(103)51(92-62(108)34-32-30-28-26-24-22-20-18-16-14-12-10-8-2)45-123-81-72(115)71(114)74(60(43-97)125-81)127-82-73(116)79(75(61(44-98)126-82)128-80-50(35-46(3)99)66(109)68(111)57(40-94)124-80)134-88(85(121)122)38-55(106)65(91-49(6)102)78(133-88)70(113)59(42-96)130-87(84(119)120)37-54(105)64(90-48(5)101)77(132-87)69(112)58(41-95)129-86(83(117)118)36-53(104)63(89-47(4)100)76(131-86)67(110)56(107)39-93/h31,33,50-61,63-82,93-98,103-107,109-116H,7-30,32,34-45H2,1-6H3,(H,89,100)(H,90,101)(H,91,102)(H,92,108)(H,117,118)(H,119,120)(H,121,122)/b33-31+/t50-,51+,52-,53+,54+,55+,56-,57-,58-,59-,60-,61-,63-,64-,65-,66-,67-,68+,69-,70-,71-,72-,73-,74-,75+,76?,77?,78?,79-,80+,81-,82+,86-,87-,88+/m1/s1
GWXCWXJFJNAEPC-IRAMQKHQSA-N
CSID:35032354, http://www.chemspider.com/Chemical-Structure.35032354.html (accessed 18:04, Apr 30, 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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