input word = C00033342

Metabolite InformationStructural formula
Name Rubinaphthin B
(-)-Rubinaphthin B
Formula C22H28O12
Mw 484.15807636
CAS RN 448962-07-0
C_ID C00033342 ,
InChIKey JZCXWLYHHFCGQT-KLIZPVTHNA-N
InChICode InChI=1S/C22H28O12/c23-7-13-15(25)17(27)19(29)21(33-13)31-11-5-6-12(10-4-2-1-3-9(10)11)32-22-20(30)18(28)16(26)14(8-24)34-22/h1-6,13-30H,7-8H2/t13-,14-,15+,16+,17+,18+,19-,20-,21-,22-/m1/s1
SMILES OC[C@H]1O[C@@H](Oc2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3ccccc23)[C@H](O)[C@@H](O)[C@@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRubiaceaeRubia yunnanensis Ref.
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