Try beta.chemspider
- Double-bond stereo
- 8 of 9 defined stereocentres
(1R,9R,16Z,19R,22R,23S,24S,25S,27R)-27-(4-Amino-2-oxo-1(2H)-pyrimidinyl)-4,6,22,24,25-pentahydroxy-23-[(1E,3S)-3-hydroxy-1-octen-1-yl]-4,6-dioxido-12,20-dioxo-3,5,7,11,26-pentaoxa-4,6-diphosphabicyclo [17.6.2]heptacos-16-en-9-yl (8Z,11Z,14Z)-8,11,14-icosatrienoate
CCCCC/C=C\C/C=C\C/C=C\CCCCCCC(=O)O[C@H]1COP(O)(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@@H](CC=CCCCC(=O)OC1)C(=O)C[C@@H](O)[C@H](/C=C/[C@@H](O)CCCCC)[C@H](O)[C@@H]2O)N1C=CC(N)=NC1=O |c:39|
InChI=1S/C52H83N3O18P2/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26-30-48(60)71-40-36-68-47(59)29-25-22-21-24-28-42-44(58)35-43(57)41(32-31-39(56)27-23-6-4-2)49(61)50(62)45(38-70-75(66,67)73-74(64,65)69-37-40)72-51(42)55-34-33-46(53)54-52(55)63/h9-10,12-13,15-16,21,24,31-34,39-43,45,49-51,56-57,61-62H,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-,43+,45+,49-,50?,51+/m0/s1
SQVYIGXVBXZURH-MIQZMGNDSA-N
CSID:117211319, http://www.chemspider.com/Chemical-Structure.117211319.html (accessed 17:49, 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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