input word = C00014711

Metabolite InformationStructural formula
Name [2R-[2alpha,3beta(S*)]]-3-[2,3-Dihydro-2,4,6-trihydroxy-2-[(4-hydroxyphenyl)methyl]-3-oxo-7-benzofuranyl]-2,3-dihydro-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
Formula C30H22O11
Mw 558.11621155
CAS RN 185250-68-4
C_ID C00014711 ,
InChIKey BJXCXTXVRPHZKR-OODWXWCLNA-N
InChICode InChI=1S/C30H22O11/c31-15-5-1-13(2-6-15)12-30(39)29(38)24-20(36)11-19(35)23(28(24)41-30)25-26(37)22-18(34)9-17(33)10-21(22)40-27(25)14-3-7-16(32)8-4-14/h1-11,25,27,31-36,39H,12H2/t25-,27+,30+/m1/s1
SMILES c1(cc(c2c(c1)O[C@H]([C@@H](C2=O)c1c(cc(c2c1O[C@@](C2=O)(O)Cc1ccc(cc1)O)O)O)c1ccc(cc1)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRhamnaceaeBerchemia zeyheri Ref.
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