input word = C00052942

Metabolite InformationStructural formula
Name Cucurbalsaminol C
Formula C31H52O4
Mw 488.38656015
CAS RN 1269766-70-2
C_ID C00052942
InChIKey HSJCULHTPJTWAJ-SOKCMQJFSA-N
InChICode InChI=1S/C31H52O4/c1-18(2)14-20(32)15-19(3)21-12-13-30(7)27-24(35-9)16-23-22(10-11-25(33)28(23,4)5)29(27,6)17-26(34)31(21,30)8/h14,16,19-22,24-27,32-34H,10-13,15,17H2,1-9H3/t19-,20+,21-,22-,24+,25+,26-,27-,29+,30+,31+/m1/s1
SMILES CO[C@H]1C=C2[C@@H](CC[C@H](O)C2(C)C)[C@]2(C)C[C@@H](O)[C@]3(C)[C@@H]([C@H](C)C[C@@H](O)C=C(C)C)CC[C@@]3(C)[C@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCucurbitaceaeMomordica balsamina Ref.
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