input word = C00036775

Metabolite InformationStructural formula
Name Atranone A
Formula C24H32O6
Mw 416.21988875
CAS RN 227597-61-7
C_ID C00036775 ,
InChIKey YFSGXEZLCNEFQI-DBXAHMEMNA-N
InChICode InChI=1S/C24H32O6/c1-12(2)15-11-17(25)29-23(5)10-9-14(4)20-18-19(22(26)28-20)24(6,27)30-21(18)13(3)7-8-16(15)23/h7,11-12,16,18-19,21,27H,8-10H2,1-6H3/b13-7+,20-14-/t16-,18+,19-,21+,23+,24-/m1/s1
SMILES [C@H]12[C@@H]3[C@@H](O[C@]1(O)C)/C(=C/C[C@H]1[C@](CC/C(=C\3/OC2=O)/C)(OC(=O)C=C1C(C)C)C)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Stachybotrys chartarum Ref.
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