Try beta.chemspider
- 21 of 21 defined stereocentres
(2S,4aR,4bS,6aR,6bR,7S,8R,9R,10aS,11aS,11bR)-6a-Formyl-9-hydroxy-4a,7-dimethyl-8-(2-methyl-1-propen-1-yl)-1,2,3,4,4a,4b,5,6,6a,6b,7,8,9,10a,11,11a,11b,12-octadecahydronaphtho[2',1':4,5]indeno[2,1-b]py ran-2-yl 2-O-[6-deoxy-4-O-(4-hydroxybenzoyl)-alpha-L-mannopyranosyl]-beta-D-glucopyranoside
C[C@@]12CC[C@H](CC1=CC[C@H]1[C@H]2CC[C@@]2(C=O)[C@@H]3[C@@H](C[C@@H]21)O[C@@H](O)[C@H](C=C(C)C)[C@H]3C)O[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1O[C@H]1O[C@@H](C)[C@H](OC(=O)C2=CC=C(O)C=C2)[C@@H](O)[C@H]1O
InChI=1S/C46H64O15/c1-21(2)16-29-22(3)34-32(58-42(29)55)18-31-28-11-8-25-17-27(12-14-45(25,5)30(28)13-15-46(31,34)20-48)57-44-40(36(51)35(50)33(19-47)59-44)61-43-38(53)37(52)39(23(4)56-43)60-41(54)24-6-9-26(49)10-7-24/h6-10,16,20,22-23,27-40,42-44,47,49-53,55H,11-15,17-19H2,1-5H3/t22-,23+,27+,28-,29+,30+,31+,32+,33-,34+,35-,36+,37+,38-,39+,40-,42-,43+,44-,45+,46-/m1/s1
DBISGXLGRVQZTK-YSOMUDLPSA-N
CSID:129306099, http://www.chemspider.com/Chemical-Structure.129306099.html (accessed 19:20, May 1, 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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