Try beta.chemspider
- Double-bond stereo
- 12 of 12 defined stereocentres
(2R,6Z)-6-({(3Z,5S)-2,5-Dihydroxy-3-[(2E)-1-hydroxy-3-(4-hydroxyphenyl)-2-propen-1-ylidene]-4,6-dioxo-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]-1-cyclohexen-1-yl} methylene)-2,5-dihydroxy-4-[(2E)-3-(4-hydroxyphenyl)-2-propenoyl]-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]-4-cyclohexene-1,3-dione
c1cc(ccc1/C=C/C(=O)C2=C(/C(=C/C3=C(/C(=C(\C=C\c4ccc(cc4)O)/O)/C(=O)[C@@](C3=O)([C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O)O)/C(=O)[C@@](C2=O)([C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)O)O)O
InChI=1S/C43H42O22/c44-14-24-30(52)32(54)34(56)40(64-24)42(62)36(58)20(28(50)26(38(42)60)22(48)11-5-16-1-7-18(46)8-2-16)13-21-29(51)27(23(49)12-6-17-3-9-19(47)10-4-17)39(61)43(63,37(21)59)41-35(57)33(55)31(53)25(15-45)65-41/h1-13,24-25,30-35,40-41,44-48,50-57,62-63H,14-15H2/b11-5+,12-6+,21-13-,26-22-/t24-,25-,30-,31-,32+,33+,34-,35-,40-,41-,42+,43-/m1/s1
UZPQVEVQJJKELH-HDOBETQRSA-N
CSID:10141987, http://www.chemspider.com/Chemical-Structure.10141987.html (accessed 18:34, Apr 25, 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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