Try beta.chemspider
- Double-bond stereo
- 8 of 9 defined stereocentres
{(1R,9R,18S,19S,22R,23S,24S,26R)-26-(4-Amino-2-oxo-1(2H)-pyrimidinyl)-4,6,19,23,24-pentahydroxy-22-[(3S)-3-hydroxy-1-octen-1-yl]-4,6-dioxido-11,21-dioxo-3,5,7,10,25-pentaoxa-4,6-diphosphabicyclo[16.6. 2]hexacos-15-en-9-yl}methyl (8Z,11Z,14Z)-8,11,14-icosatrienoate
CCCCC/C=C\C/C=C\C/C=C\CCCCCCC(=O)OC[C@@H]1COP(O)(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@@H](CC=CCCCC(=O)O1)[C@@H](O)CC(=O)[C@H](C=C[C@@H](O)CCCCC)[C@H](O)[C@@H]2O)N1C=CC(N)=NC1=O
InChI=1S/C52H83N3O18P2/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25-29-47(59)68-36-40-37-69-74(64,65)73-75(66,67)70-38-45-50(62)49(61)41(32-31-39(56)27-23-6-4-2)43(57)35-44(58)42(28-24-21-22-26-30-48(60)71-40)51(72-45)55-34-33-46(53)54-52(55)63/h9-10,12-13,15-16,21,24,31-34,39-42,44-45,49-51,56,58,61-62H,3-8,11,14,17-20,22-23,25-30,35-38H2,1-2H3,(H,64,65)(H,66,67)(H2,53,54,63)/b10-9-,13-12-,16-15-,24-21-,32-31?/t39-,40+,41-,42-,44?,45+,49-,50+,51+/m0/s1
NQSVWXXZXYIQPH-WGAHFAAGSA-N
CSID:117211320, http://www.chemspider.com/Chemical-Structure.117211320.html (accessed 17:39, Jul 4, 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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