input word = C00039509

Metabolite InformationStructural formula
Name Jungermatrobrunin A
Formula C24H32O8
Mw 448.209718
CAS RN 1042692-68-1
C_ID C00039509 ,
InChIKey WXIBMYGOGQQGHB-AMCPOFCWNA-N
InChICode InChI=1S/C24H32O8/c1-11-15-9-14-10-16(29-12(2)25)19-21(4,5)8-7-17(30-13(3)26)22(19,6)23(14)20(18(15)27)24(11,28)32-31-23/h10,15-20,27-28H,1,7-9H2,2-6H3/t15-,16-,17+,18-,19-,20+,22-,23-,24+/m1/s1
SMILES C=C1[C@H]2CC3=C[C@H](OC(C)=O)[C@@H]4C(C)(C)CC[C@H](OC(C)=O)[C@@]4(C)[C@@]34OO[C@]1(O)C4[C@H]2O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeJungermanniaceaeJungermannia atrobrunnea Ref.
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