input word = C00003009

Metabolite InformationStructural formula
Name Ohioensin A
Formula C23H16O5
Mw 372.09977362
CAS RN 121353-47-7
C_ID C00003009 ,
InChIKey DBGJQYIYUBGFLT-RLBIMARFNA-N
InChICode InChI=1S/C23H16O5/c24-10-5-6-12-14(7-10)23-20-13(11-3-1-2-4-18(11)28-23)8-15(25)21-17(27)9-16(26)19(12)22(20)21/h1-7,9,13,20,23-24,26-27H,8H2/t13-,20+,23+/m1/s1
SMILES O=C1C[C@@H]2c3ccccc3O[C@H]3c4cc(O)ccc4-c4c(O)cc(O)c1c4[C@H]23
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePolytrichaceaePolytrichum ohioense Ref.
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OrganismPolytrichum ohioense
ReferenceHarborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter47