Try beta.chemspider
- 10 of 11 defined stereocentres
{(1S,2S,3S,4R,5R,6S,7S,9R,10R,12R)-4,5,7-Triacetoxy-6-(acetoxymethyl)-2,12-dihydroxy-2,10-dimethyl-3-[(2-methylbutanoyl)oxy]-8-oxo-11-oxatricyclo[7.2.1.0~1,6~]dodec-10-yl}methyl benzoate
O=C(OC[C@@]1(O[C@]32[C@]([C@H](OC(=O)C)C(=O)[C@@H]1[C@H]2O)([C@@H](OC(=O)C)[C@@H](OC(=O)C)[C@H](OC(=O)C(C)CC)[C@@]3(O)C)COC(=O)C)C)c4ccccc4
InChI=1S/C35H44O16/c1-9-17(2)30(42)50-28-25(47-19(4)37)29(49-21(6)39)34(16-45-18(3)36)27(48-20(5)38)24(40)23-26(41)35(34,33(28,8)44)51-32(23,7)15-46-31(43)22-13-11-10-12-14-22/h10-14,17,23,25-29,41,44H,9,15-16H2,1-8H3/t17?,23-,25+,26-,27-,28+,29+,32+,33+,34-,35+/m1/s1
IKSISPJSWYJLRV-AXDMLNCRSA-N
CSID:8525383, http://www.chemspider.com/Chemical-Structure.8525383.html (accessed 19:33, Jul 27, 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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