input word = C00006540

Metabolite InformationStructural formula
Name 2'',3''-Dihydroisocryptomerin
Formula C31H22O10
Mw 554.12129692
CAS RN 168029-93-4
C_ID C00006540 ,
InChIKey UDOPUTXQVBNOLI-FQKVKQEKNA-N
InChICode InChI=1S/C31H22O10/c1-38-27-14-26-29(22(36)13-24(41-26)15-2-6-17(32)7-3-15)30(37)31(27)39-19-8-4-16(5-9-19)23-12-21(35)28-20(34)10-18(33)11-25(28)40-23/h2-12,14,24,32-34,37H,13H2,1H3/t24-/m0/s1
SMILES COc1cc2c(c(O)c1Oc1ccc(-c3cc(=O)c4c(O)cc(O)cc4o3)cc1)C(=O)C[C@@H](c1ccc(O)cc1)O2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Selaginella willdenowii Ref.
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OrganismSelaginella willdenowii
ReferenceHarborne, The Handbook of Natural Flavonoids, 1, (1999), 645,Biflavonyls

Silva,Phytochem.,40,(1995),129