input word = C00034533

Metabolite InformationStructural formula
Name Herbarumin II
(+)-Herbarumin II
Formula C12H20O5
Mw 244.13107375
CAS RN 297174-26-6
C_ID C00034533 ,
InChIKey KQJGPGHQDDZVHJ-OOKCGHSFNA-N
InChICode InChI=1S/C12H20O5/c1-2-5-10-11(15)8(13)6-3-4-7-9(14)12(16)17-10/h3,6,8-11,13-15H,2,4-5,7H2,1H3/b6-3-/t8-,9+,10-,11+/m1/s1
SMILES C1C/C=C\[C@H]([C@@H]([C@H](OC(=O)[C@H]1O)CCC)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiIncertae sedisPhoma herbarum Ref.
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