Try beta.chemspider
- 5 of 7 defined stereocentres
(7R,8S,26R,28S,29R)-1,13,14,15,18,19,20,34,35,39,39-Undecahydroxy-2,5,10,23,31-pentaoxo-6,9,24,27,30,40-hexaoxaoctacyclo[34.3.1.0~4,38~.0~7,26~.0~8,29~.0~11,16~.0~17,22~.0~32,37~]tetraconta-3,11,13,15 ,17,19,21,32,34,36-decaen-28-yl 3,4,5-trihydroxybenzoate
O=C7O[C@H]4[C@@H]9OC(=O)\C2=C\C(=O)C3(O)Oc1c(O)c(O)cc(c1C2C3(O)O)C(=O)O[C@H]4[C@H](OC(=O)c5cc(O)c(O)c(O)c5)O[C@@H]9COC(=O)c6c(c(O)c(O)c(O)c6)c8c7cc(O)c(O)c8O
InChI=1S/C41H28O27/c42-13-1-8(2-14(43)24(13)48)34(54)67-39-33-32-30(64-38(58)12-6-19(47)41(61)40(59,60)23(12)22-11(37(57)66-33)5-17(46)27(51)31(22)68-41)18(63-39)7-62-35(55)9-3-15(44)25(49)28(52)20(9)21-10(36(56)65-32)4-16(45)26(50)29(21)53/h1-6,18,23,30,32-33,39,42-46,48-53,59-61H,7H2/t18-,23?,30-,32+,33-,39+,41?/m1/s1
JQQBXPCJFAKSPG-PYGBXMOSSA-N
CSID:8008643, http://www.chemspider.com/Chemical-Structure.8008643.html (accessed 12:35, May 5, 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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