input word = C00018391

Metabolite InformationStructural formula
Name Thielavin A
Formula C29H30O10
Mw 538.18389718
CAS RN 71950-66-8
C_ID C00018391 ,
InChIKey MGGMNKJGDSNTKZ-UHFFFAOYSA-N
InChICode InChI=1S/C29H30O10/c1-10-9-18(30)15(6)22(31)19(10)28(36)38-26-14(5)12(3)21(24(33)17(26)8)29(37)39-25-13(4)11(2)20(27(34)35)23(32)16(25)7/h9,30-33H,1-8H3,(H,34,35)
SMILES c1(c(c(c(c(c1O)C)OC(=O)c1c(c(c(c(c1O)C)OC(=O)c1c(c(c(cc1C)O)C)O)C)C)C)C)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiChaetomiaceaeThielavia terricola Ref.
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