input word = C00014663

Metabolite InformationStructural formula
Name Dalmaisione D
2'-Hydroxyaurone 2'-O-glucosyl-(1'''->6'')-glucoside
2'-Hydroxyaurone 2'-gentiobioside
Formula C27H30O13
Mw 562.16864105
CAS RN 418810-16-9
C_ID C00014663 ,
InChIKey QKEXFCYHIQKPSV-PTYSHMOPNA-N
InChICode InChI=1S/C27H30O13/c28-10-17-20(30)22(32)24(34)26(39-17)36-11-18-21(31)23(33)25(35)27(40-18)38-14-7-3-1-5-12(14)9-16-19(29)13-6-2-4-8-15(13)37-16/h1-9,17-18,20-28,30-35H,10-11H2/b16-9-/t17-,18-,20-,21-,22+,23+,24+,25-,26-,27-/m1/s1
SMILES c1ccc2c(c1)O/C(=C\c1ccccc1O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO[C@H]1[C@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O)O)O)/C2=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePolygalaceaePolygala dalmaisiana Ref.
zoom in