input word = C00042925

Metabolite InformationStructural formula
Name Salcolin B
Formula C27H26O11
Mw 526.14751167
CAS RN 369390-52-3
C_ID C00042925 ,
InChIKey WXNJNHFYIWEHIL-LIIQWTDENA-N
InChICode InChI=1S/C27H26O11/c1-34-20-6-13(4-5-16(20)30)26(33)24(12-28)38-27-22(35-2)7-14(8-23(27)36-3)19-11-18(32)25-17(31)9-15(29)10-21(25)37-19/h4-11,24,26,28-31,33H,12H2,1-3H3/t24-,26+/m1/s1
SMILES c1(cc(c2c(c1)oc(cc2=O)c1cc(c(c(c1)OC)O[C@@H]([C@H](c1cc(c(cc1)O)OC)O)CO)OC)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePoaceaeAvena sativa Ref.
PlantaePoaceaeOryza sativa Ref.
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