input word = C00053404

Metabolite InformationStructural formula
Name Karavoate Q
Formula C35H56O6
Mw 572.40768952
CAS RN 2009357-41-7
C_ID C00053404
InChIKey YVHJVAYWUJTPKD-DKOHYKDJSA-N
InChICode InChI=1S/C35H56O6/c1-21(2)18-23(41-30(39)13-12-29(37)38)19-22(3)24-14-15-35(8)31-27(40-9)20-26-25(10-11-28(36)32(26,4)5)33(31,6)16-17-34(24,35)7/h18,20,22-25,27-28,31,36H,10-17,19H2,1-9H3,(H,37,38)/t22-,23+,24-,25-,27+,28+,31-,33+,34-,35+/m1/s1
SMILES CO[C@H]1C=C2[C@@H](CC[C@H](O)C2(C)C)[C@]2(C)CC[C@]3(C)[C@@H]([C@H](C)C[C@H](C=C(C)C)OC(=O)CCC(=O)O)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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OrganismMomordica balsamina
ReferenceRamalhete, C. et al., Planta Med., 84, (2018), 1372-1379.