input word = C00029503

Metabolite InformationStructural formula
Name 3'-Hydroxymethylrocaglate
(-)-3'-Hydroxymethylrocaglate
Formula C28H28O9
Mw 508.17333249
CAS RN 222854-54-8
C_ID C00029503 ,
InChIKey MKTMWKCGQTXSNC-SFMZEOQPNA-N
InChICode InChI=1S/C28H28O9/c1-33-17-13-20(35-3)24-21(14-17)37-28(16-10-11-19(34-2)18(29)12-16)23(15-8-6-5-7-9-15)22(26(31)36-4)25(30)27(24,28)32/h5-14,22-23,25,29-30,32H,1-4H3/t22-,23-,25-,27-,28+/m1/s1
SMILES COC(=O)[C@@H]1C(c2ccccc2)C2(c3ccc(OC)c(O)c3)Oc3cc(OC)cc(OC)c3C2(O)[C@@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeAmoora cucullata Ref.
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