input word = C00051169

Metabolite InformationStructural formula
Name Kupitengester 2
Formula C32H37NO9
Mw 579.24683179
CAS RN 149183-64-2
C_ID C00051169
InChIKey LZNSJZIULKYEKR-UHFFFAOYNA-N
InChICode InChI=1S/C32H37NO9/c1-19-13-14-25(40-28(36)22-10-7-6-8-11-22)31(18-38-20(2)34)27(39-21(3)35)26(24-16-32(19,31)42-30(24,4)5)41-29(37)23-12-9-15-33-17-23/h6-12,15,17,19,24-27H,13-14,16,18H2,1-5H3
SMILES CC(=O)OCC12C(OC(=O)c3ccccc3)CCC(C)C13CC(C(OC(=O)c1cccnc1)C2OC(C)=O)C(C)(C)O3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCelastraceaeCelastrus angulatus Ref.
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