input word = C00042924

Metabolite InformationStructural formula
Name Salcolin A
Formula C27H26O11
Mw 526.14751167
CAS RN 369390-51-2
C_ID C00042924 ,
InChIKey WXNJNHFYIWEHIL-OXEVFYLTNA-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 COc1cc([C@@H](O)[C@@H](CO)Oc2c(OC)cc(-c3cc(=O)c4c(O)cc(O)cc4o3)cc2OC)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePoaceaeAvena sativa Ref.
PlantaePoaceaeOryza sativa Ref.
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OrganismOryza sativa
Referencehttps://doi.org/10.1111/jipb.12204