input word = C00048681

Metabolite InformationStructural formula
Name Cytosporin E
(+)-Cytosporin E
Formula C20H30O7
Mw 382.19915331
CAS RN 1036931-42-6
C_ID C00048681 ,
InChIKey IMQYAWIJNZPDJB-HXTLRGFLNA-N
InChICode InChI=1S/C20H30O7/c1-4-5-6-7-8-9-12-13(11-21)16-20(24,10-14(22)19(2,3)27-16)17-15(12)25-18(23)26-17/h8-9,14-17,21-22,24H,4-7,10-11H2,1-3H3/b9-8+/t14-,15+,16-,17+,20+/m0/s1
SMILES C1[C@]2([C@@H](OC([C@H]1O)(C)C)C(=C([C@@H]1[C@H]2OC(=O)O1)/C=C/CCCCC)CO)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiDiatrypaceaeEutypella scoparia Ref.
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OrganismEutypella scoparia
ReferenceBlunt,Nat.Prod.Rep.,27,(2010),165