input word = C00021222

Metabolite InformationStructural formula
Name (3beta)-28-Norlup-20(29)-ene-3,17-diol
Formula C29H48O2
Mw 428.36543078
CAS RN 202651-66-9
C_ID C00021222 ,
InChIKey QMYGTTSPVRKRJP-UUORKCOBNA-N
InChICode InChI=1S/C29H48O2/c1-18(2)19-10-15-29(31)17-16-27(6)20(24(19)29)8-9-22-26(5)13-12-23(30)25(3,4)21(26)11-14-28(22,27)7/h19-24,30-31H,1,8-17H2,2-7H3/t19-,20+,21-,22+,23-,24-,26-,27+,28+,29-/m0/s1
SMILES C=C(C)[C@@H]1CC[C@]2(O)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMyrtaceaeMelaleuca leucadendron Ref.
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