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- Double-bond stereo
- 11 of 11 defined stereocentres
(3beta,22beta)-22,28-Dihydroxyurs-12-en-3-yl (2E)-3-(3,4-dihydroxyphenyl)acrylate
C[C@@H]1C[C@H]([C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H](C5(C)C)OC(=O)/C=C/c6ccc(c(c6)O)O)C)C)[C@@H]2[C@H]1C)C)CO)O
InChI=1S/C39H56O6/c1-23-20-31(43)39(22-40)19-18-37(6)26(34(39)24(23)2)10-12-30-36(5)16-15-32(35(3,4)29(36)14-17-38(30,37)7)45-33(44)13-9-25-8-11-27(41)28(42)21-25/h8-11,13,21,23-24,29-32,34,40-43H,12,14-20,22H2,1-7H3/b13-9+/t23-,24+,29+,30-,31-,32+,34+,36+,37-,38-,39-/m1/s1
HVTRDYCUOUZNAP-XVVDDNTPSA-N
CSID:24687564, http://www.chemspider.com/Chemical-Structure.24687564.html (accessed 05:43, Jun 7, 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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