Try beta.chemspider
- 4 of 4 defined stereocentres
(3R,4S,5R,6R)-3,5,6-Trihydroxy-1,2-dioxo-7-[(3,4,5-trihydroxybenzoyl)oxy]-1-(3,4,5-trihydroxyphenyl)-4-heptanyl 3,4,5-trihydroxybenzoate - D-glucose (1:1)
c1c(cc(c(c1O)O)O)C(=O)C(=O)[C@@H]([C@H]([C@@H]([C@@H](COC(=O)c2cc(c(c(c2)O)O)O)O)O)OC(=O)c3cc(c(c(c3)O)O)O)O.C([C@H]([C@H]([C@@H]([C@H](C=O)O)O)O)O)O
InChI=1S/C27H24O18.C6H12O6/c28-11-1-8(2-12(29)19(11)36)18(35)23(40)24(41)25(45-27(43)10-5-15(32)21(38)16(33)6-10)22(39)17(34)7-44-26(42)9-3-13(30)20(37)14(31)4-9;7-1-3(9)5(11)6(12)4(10)2-8/h1-6,17,22,24-25,28-34,36-39,41H,7H2;1,3-6,8-12H,2H2/t17-,22-,24+,25+;3-,4+,5+,6+/m10/s1
IQNZYXVNCVNZOV-HFBLQDFRSA-N
CSID:23254279, http://www.chemspider.com/Chemical-Structure.23254279.html (accessed 04:01, Apr 24, 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
No predicted properties have been calculated for this compound.
Click to predict properties on the Chemicalize site
Advertisement
Spotlight