input word = C00049292

Metabolite InformationStructural formula
Name Rubrosulphin
Formula C29H20O10
Mw 528.10564686
CAS RN 55713-15-0
C_ID C00049292 ,
InChIKey XRRCXEFWLWRGLZ-UHFFFAOYNA-N
InChICode InChI=1S/C29H20O10/c1-9-4-11-6-13-8-15(36-3)20-21-25(33)19-14(7-12-5-10(2)38-29(35)18(12)24(19)32)22(30)27(21)39-26(20)16(13)23(31)17(11)28(34)37-9/h6-10,31-32H,4-5H2,1-3H3/t9-,10-/m1/s1
SMILES COc1cc2cc3c(c(O)c2c2oc4c(c12)C(=O)c1c(cc2c(c1O)C(=O)OC(C)C2)C4=O)C(=O)OC(C)C3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeAspergillus melleus Ref.
FungiTrichocomaceaeAspergillus sulphureus Ref.
FungiTrichocomaceaePenicillium viridicatum Ref.
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