Try beta.chemspider
- 16 of 18 defined stereocentres
(3beta,5beta,9xi,17xi)-3-{[4-O-(beta-D-Allopyranosyl)-6-deoxy-beta-D-gulopyranosyl]oxy}-5,14-dihydroxy-19-oxobufa-20,22-dienolide
C[C@@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@H]2CC[C@@]3(C4CC[C@@]5(C(CC[C@@]5([C@@H]4CC[C@@]3(C2)O)O)c6ccc(=O)oc6)C)C=O)O)O)O[C@H]7[C@@H]([C@@H]([C@@H]([C@H](O7)CO)O)O)O
InChI=1S/C36H52O15/c1-17-30(51-32-28(43)26(41)25(40)23(14-37)50-32)27(42)29(44)31(48-17)49-19-5-10-34(16-38)21-6-9-33(2)20(18-3-4-24(39)47-15-18)8-12-36(33,46)22(21)7-11-35(34,45)13-19/h3-4,15-17,19-23,25-32,37,40-46H,5-14H2,1-2H3/t17-,19+,20?,21?,22-,23-,25-,26-,27+,28-,29-,30+,31+,32+,33-,34+,35+,36+/m1/s1
DCSLTSSPIJWEJN-BSNNCTNFSA-N
CSID:4884781, http://www.chemspider.com/Chemical-Structure.4884781.html (accessed 18:50, May 16, 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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