input word = C00038668

Metabolite InformationStructural formula
Name Butyrolactone I 4''-sulfate
(+)-Butyrolactone I 4''-sulfate
Formula C24H24O10S
Mw 504.10901772
CAS RN 1012860-65-9
C_ID C00038668 ,
InChIKey NWSMSBOLLCRCSY-FQKVKQEKNA-N
InChICode InChI=1S/C24H24O10S/c1-14(2)4-6-17-12-15(5-11-19(17)34-35(29,30)31)13-24(23(28)32-3)20(21(26)22(27)33-24)16-7-9-18(25)10-8-16/h4-5,7-12,25-26H,6,13H2,1-3H3,(H,29,30,31)/t24-/m1/s1
SMILES C1(=O)C(=C([C@@](O1)(C(=O)OC)Cc1cc(c(cc1)OS(=O)(=O)O)CC=C(C)C)c1ccc(cc1)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeAspergillus terreus HK10499 Ref.
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