input word = C00057454

Metabolite InformationStructural formula
Name MS 3
Formula C21H24O7
Mw 388.15220312
CAS RN 58265-74-0
C_ID C00057454
InChIKey WTZUCTQSBSDSRG-UHFFFAOYSA-N
InChICode InChI=1S/C21H24O7/c1-11(2)4-5-15-18(7-13(9-22)16(10-23)20(15)26)28-21(27)19-12(3)6-14(24)8-17(19)25/h4,6-8,22-26H,5,9-10H2,1-3H3
SMILES CC(C)=CCc1c(OC(=O)c2c(C)cc(O)cc2O)cc(CO)c(CO)c1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiStereaceaeStereum hirsutum Ref.
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OrganismStereum hirsutum
ReferenceKurasawa, S. et al., Agric. Biol. Chem., 1975, 39, 2003-2008

2009-2014

1976, 40, 1781-1784 (isol, struct, cryst struct, activity)