input word = C00053400

Metabolite InformationStructural formula
Name Karavoate M
Formula C39H58O5
Mw 606.42842496
CAS RN 1269766-65-5
C_ID C00053400
InChIKey NPGBXYSTOACVFB-OSYADQOCSA-N
InChICode InChI=1S/C39H58O5/c1-24(2)21-28(44-35(41)26-11-13-27(42-9)14-12-26)22-25(3)29-17-18-39(8)34-32(43-10)23-31-30(15-16-33(40)36(31,4)5)37(34,6)19-20-38(29,39)7/h11-14,21,23,25,28-30,32-34,40H,15-20,22H2,1-10H3/t25-,28+,29-,30-,32+,33+,34-,37+,38-,39+/m1/s1
SMILES COc1ccc(C(=O)O[C@@H](C=C(C)C)C[C@@H](C)[C@H]2CC[C@@]3(C)[C@@H]4[C@@H](OC)C=C5[C@@H](CC[C@H](O)C5(C)C)[C@]4(C)CC[C@]23C)cc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCucurbitaceaeMomordica balsamina Ref.
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