input word = C00000534

Metabolite InformationStructural formula
Name Stemphyloxin I
Formula C21H34O6
Mw 382.23553882
CAS RN 81210-11-9
C_ID C00000534 ,
InChIKey YRECHDUAXCBBOZ-OIXVEOGJNA-N
InChICode InChI=1S/C21H34O6/c1-6-13(11-23)17-20(4,15(24)7-8-22)16-12(2)9-19(3,26)10-14(16)18(25)21(17,5)27/h7-8,12-14,16-17,22-23,26-27H,6,9-11H2,1-5H3/b8-7-/t12-,13+,14+,16+,17-,19-,20+,21+/m1/s1
SMILES [C@@H]1([C@@](C(=O)[C@@H]2[C@@H]([C@@]1(C(=O)/C=C\O)C)[C@@H](C[C@](C2)(O)C)C)(O)C)[C@H](CO)CC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiPleosporaceaeStemphylium botryosum Ref.
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