Try beta.chemspider
- Double-bond stereo
- 5 of 5 defined stereocentres
(1S)-1,5-Anhydro-2-O-[(2E)-3-(4-hydroxy-3-methoxyphenyl)-2-propenoyl]-1-[7-hydroxy-5-methyl-4-oxo-2-(2-oxopropyl)-4H-chromen-8-yl]-D-allitol
Cc1cc(c(c2c1c(=O)cc(o2)CC(=O)C)[C@H]3[C@@H]([C@@H]([C@@H]([C@H](O3)CO)O)O)OC(=O)/C=C/c4ccc(c(c4)OC)O)O
InChI=1S/C29H30O12/c1-13-8-18(33)24(27-23(13)19(34)11-16(39-27)9-14(2)31)28-29(26(37)25(36)21(12-30)40-28)41-22(35)7-5-15-4-6-17(32)20(10-15)38-3/h4-8,10-11,21,25-26,28-30,32-33,36-37H,9,12H2,1-3H3/b7-5+/t21-,25-,26-,28+,29-/m1/s1
BRMXVUVCULYUAM-UXSZSWSSSA-N
CSID:4475251, http://www.chemspider.com/Chemical-Structure.4475251.html (accessed 19:36, 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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