input word = C00024012

Metabolite InformationStructural formula
Name Diplodiol
Diplosporin
trans-6-Ethyl-5-hydroxy-3-hydroxymethyl-5,6,7,8-tetrahydrochromone
(5S,6X)-6-Ethyl-5-hydroxy-3-hydroxymethyl-5,6,7,8-tetrahydrobenzo[b]pyran-4-one
Formula C12H16O4
Mw 224.104859
CAS RN 69199-05-9
C_ID C00024012 ,
InChIKey BFQQKLXDPGTJKC-SMLPMWDWNA-N
InChICode InChI=1S/C12H16O4/c1-2-7-3-4-9-10(11(7)14)12(15)8(5-13)6-16-9/h6-7,11,13-14H,2-5H2,1H3/t7-,11+/m1/s1
SMILES C1[C@H]([C@@H](c2c(C1)occ(c2=O)CO)O)CC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiBotryosphaeriaceaeDiplodia macrospora ATTC 36896 Ref.
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