input word = C00045704

Metabolite InformationStructural formula
Name Bromosphaerone
(-)-Bromosphaerone
Formula C20H30Br2O3
Mw 476.05617062
CAS RN 361344-22-1
C_ID C00045704 ,
InChIKey JGVFMEFXYFJJSK-VHYUOZRUNA-N
InChICode InChI=1S/C20H30Br2O3/c1-11(2)12-5-6-13(23)16-17-18(3,7-8-20(12,16)10-21)14(22)9-15(24)19(17,4)25/h5-6,11-12,14-17,24-25H,7-10H2,1-4H3/t12-,14-,15-,16-,17-,18+,19+,20-/m0/s1
SMILES [C@@H]1(C[C@@H]([C@@]2([C@@H]([C@]1(C)O)[C@H]1[C@](CC2)([C@@H](C=CC1=O)C(C)C)CBr)C)Br)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Sphaerococcus coronopifolius Ref.
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