- 5 of 5 defined stereocentres
(12R,14S,15R,16R,17R)-4,5,6,22,23,29,30-Heptahydroxy-9,19,26-trioxo-2,10,13,18,25-pentaoxahexacyclo[18.9.3.0~3,8~.0~12,17~.0~24,32~.0~27,31~]dotriaconta-1(29),3,5,7,20(32),21,23,27,30-nonaene-14,15,16 -triyl tris(3,4,5-trihydroxybenzoate)
c1c(cc(c(c1O)O)O)C(=O)O[C@@H]2[C@H]3[C@@H](COC(=O)c4cc(c(c(c4Oc5c(cc6c(c5O)c7c(cc(c(c7oc6=O)O)O)C(=O)O3)O)O)O)O)O[C@H]([C@@H]2OC(=O)c8cc(c(c(c8)O)O)O)OC(=O)c9cc(c(c(c9)O)O)O
InChI=1S/C48H32O30/c49-17-1-11(2-18(50)29(17)58)42(65)76-40-38-26(72-48(78-44(67)13-5-21(53)31(60)22(54)6-13)41(40)77-43(66)12-3-19(51)30(59)20(52)4-12)10-71-45(68)16-9-23(55)32(61)35(64)36(16)73-37-25(57)8-14-27(34(37)63)28-15(47(70)74-38)7-24(56)33(62)39(28)75-46(14)69/h1-9,26,38,40-41,48-64H,10H2/t26-,38-,40-,41-,48+/m1/s1
DOTJYWQAPHIAIF-TWNAEOARSA-N
CSID:28190824, http://www.chemspider.com/Chemical-Structure.28190824.html (accessed 05:40, Mar 29, 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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