input word = C00051792

Metabolite InformationStructural formula
Name Preaquamycin
Preakuammicine
Formula C21H24N2O3
Mw 352.17869265
CAS RN 23924-90-5
C_ID C00051792
InChIKey DSOCELULQRKOMA-QLKAYGNNSA-N
InChICode InChI=1S/C21H24N2O3/c1-3-13-11-23-9-8-20-14-6-4-5-7-16(14)22-18(20)21(12-24,19(25)26-2)15(13)10-17(20)23/h3-7,15,17,24H,8-12H2,1-2H3/b13-3-/t15-,17-,20+,21-/m0/s1
SMILES C/C=C1\CN2CCC34C(=Nc5ccccc53)C(CO)(C(=O)OC)C1CC24
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeAlstonia angustiloba Ref.
PlantaeApocynaceaeAlstonia scholaris Ref.
PlantaeApocynaceaeCatharanthus roseus Ref.
PlantaeApocynaceaeStrempeliopsis strempelioides Ref.
PlantaeLonganiaceaeStrychnos nux-vomica Ref.
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