Try beta.chemspider
- Double-bond stereo
- 10 of 12 defined stereocentres
2-(3,4-Dihydroxyphenyl)ethyl (5xi)-6-O-{[(2S,3Z,4S)-3-ethylidene-2-(D-glucopyranosyloxy)-5-(methoxycarbonyl)-3,4-dihydro-2H-pyran-4-yl]acetyl}-beta-L-xylo-hexopyranoside
C/C=C\1/[C@@H](C(=CO[C@H]1OC2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)C(=O)OC)CC(=O)OCC3[C@@H]([C@H]([C@@H]([C@H](O3)OCCc4ccc(c(c4)O)O)O)O)O
InChI=1S/C31H42O18/c1-3-14-15(16(28(42)43-2)11-46-29(14)49-31-27(41)24(38)22(36)19(10-32)47-31)9-21(35)45-12-20-23(37)25(39)26(40)30(48-20)44-7-6-13-4-5-17(33)18(34)8-13/h3-5,8,11,15,19-20,22-27,29-34,36-41H,6-7,9-10,12H2,1-2H3/b14-3-/t15-,19+,20?,22+,23-,24-,25+,26-,27+,29-,30-,31?/m0/s1
IQOYABZSYGZAAQ-XHQMDLIKSA-N
CSID:4978178, http://www.chemspider.com/Chemical-Structure.4978178.html (accessed 02:56, Jul 5, 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
Advertisement
Spotlight