input word = C00035075

Metabolite InformationStructural formula
Name Cryptoporic acid I
Formula C21H32O8
Mw 412.209718
CAS RN 135118-47-7
C_ID C00035075 ,
InChIKey NXBOOZAQZQINMQ-URDISUDONA-N
InChICode InChI=1S/C21H32O8/c1-11-5-6-14-20(2,3)15(22)7-8-21(14,4)13(11)10-29-17(19(27)28)12(18(25)26)9-16(23)24/h12-15,17,22H,1,5-10H2,2-4H3,(H,23,24)(H,25,26)(H,27,28)/t12-,13-,14-,15-,17+,21-/m0/s1
SMILES C1(=C)CC[C@@H]2[C@]([C@H]1CO[C@H]([C@H](CC(=O)O)C(=O)O)C(=O)O)(CC[C@@H](C2(C)C)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiGanodermataceaeGanoderma neojaponicum Ref.
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