Try beta.chemspider
- 17 of 19 defined stereocentres
(3beta,5xi,9xi,12alpha)-12,19-Dihydroxy-28-oxo-20,28-epoxyurs-13(18)-en-3-yl 2-O-(6-deoxy-alpha-L-mannopyranosyl)-alpha-L-arabinopyranoside
CC1(C)C2CC[C@]3(C)C(C[C@H](O)C4=C5[C@@]6(CC[C@@]34C)CC[C@](C)(OC6=O)[C@@]5(C)O)[C@@]2(C)CC[C@@H]1O[C@@H]1OC[C@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O
InChI=1S/C41H64O13/c1-19-26(44)28(46)29(47)32(51-19)53-30-27(45)21(43)18-50-33(30)52-24-10-11-36(4)22(35(24,2)3)9-12-37(5)23(36)17-20(42)25-31-40(8,49)39(7)14-16-41(31,34(48)54-39)15-13-38(25,37)6/h19-24,26-30,32-33,42-47,49H,9-18H2,1-8H3/t19-,20-,21-,22?,23?,24-,26-,27-,28+,29+,30+,32-,33-,36-,37+,38+,39-,40-,41+/m0/s1
SJXTZRXLMREHNE-BERUVVNUSA-N
CSID:90615865, http://www.chemspider.com/Chemical-Structure.90615865.html (accessed 19:08, May 21, 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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