Try beta.chemspider
- 12 of 12 defined stereocentres
2-(3,4-Dihydroxyphenyl)ethyl 6-O-{[(2S,3E,4R)-3-ethylidene-2-(beta-D-mannopyranosyloxy)-5-(methoxycarbonyl)-3,4-dihydro-2H-pyran-4-yl]acetyl}-beta-D-galactopyranoside
COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)C(=CC)[C@H]1CC(=O)OC[C@H]1O[C@@H](OCCC2C=C(O)C(O)=CC=2)[C@H](O)[C@@H](O)[C@H]1O
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/t15-,19-,20-,22-,23+,24+,25+,26-,27+,29+,30-,31+/m1/s1
IQOYABZSYGZAAQ-VBBXXKLWSA-N
CSID:114642707, http://www.chemspider.com/Chemical-Structure.114642707.html (accessed 02:03, 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
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