input word = C00034336

Metabolite InformationStructural formula
Name Waltherione A
Formula C23H23NO5
Mw 393.15762285
CAS RN 861807-88-7
C_ID C00034336 ,
InChIKey VTNKIOPLJCPQRL-FMKFCMHCNA-N
InChICode InChI=1S/C23H23NO5/c1-12-22(28-3)21(25)20-15(24-12)9-8-14-19(20)17-10-11-18(29-17)23(14,26)13-6-4-5-7-16(13)27-2/h4-9,17-18,26H,10-11H2,1-3H3,(H,24,25)/t17-,18+,23+/m0/s1
SMILES COc1ccccc1[C@@]1(O)c2ccc3[nH]c(C)c(OC)c(=O)c3c2[C@@H]2CC[C@H]1O2
Start Substs in Alk. Biosynthesis (Prediction) Anthranilate
Organism
Kingdom Family Species Reference
PlantaeMalvaceaeMelochia chamaedrys Ref.
PlantaeMalvaceaeWaltheria douradinha Ref.
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