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- Double-bond stereo
- 28 of 28 defined stereocentres
(2S,3R,4E)-3-Hydroxy-2-(tetracosanoylamino)-4-octadecen-1-yl (6R)-5-acetamido-3,5-dideoxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]-beta-L-threo-hex-2-ulopyranonosyl-(2->6)-beta-D-galactopyranosyl-(1->3)-2-a cetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside
CC(=O)N[C@H]1[C@@H](O[C@@](C[C@@H]1O)(OC[C@H]1O[C@@H](O[C@@H]2[C@@H](NC(C)=O)[C@@H](O[C@H](CO)[C@H]2O)O[C@H]2[C@@H](O)[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](CO)O[C@@H](OC[C@H](NC(=O)CCCCCCCCCCCCCCCCCCCCCCC)[C@H](O)/C=C/CCCCCCCCCCCCC)[C@H](O)[C@H]3O)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O)C(O)=O)[C@H](O)[C@H](O)CO
InChI=1S/C79H143N3O31/c1-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-28-30-32-34-36-38-40-58(92)82-50(51(89)39-37-35-33-31-29-27-18-16-14-12-10-8-6-2)46-104-75-68(100)66(98)70(56(45-86)108-75)110-77-69(101)73(64(96)55(44-85)107-77)112-74-60(81-49(4)88)71(63(95)54(43-84)106-74)111-76-67(99)65(97)62(94)57(109-76)47-105-79(78(102)103)41-52(90)59(80-48(3)87)72(113-79)61(93)53(91)42-83/h37,39,50-57,59-77,83-86,89-91,93-101H,5-36,38,40-47H2,1-4H3,(H,80,87)(H,81,88)(H,82,92)(H,102,103)/b39-37+/t50-,51+,52-,53+,54+,55+,56+,57+,59+,60+,61+,62-,63+,64-,65-,66+,67+,68+,69+,70+,71+,72+,73-,74-,75+,76-,77-,79+/m0/s1
QVCIROIPESDMOX-OLNLSSKGSA-N
CSID:113384428, http://www.chemspider.com/Chemical-Structure.113384428.html (accessed 04:54, May 22, 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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