input word = C00038778

Metabolite InformationStructural formula
Name Cipadessalide
(-)-Cipadessalide
Formula C33H42O12
Mw 630.26762681
CAS RN 1013027-43-4
C_ID C00038778 ,
InChIKey IGAWJAFLFPMXQD-CMZUGCLRNA-N
InChICode InChI=1S/C33H42O12/c1-6-16(2)27(38)30(39)44-29-28(43-15-34)26-18(25-20(35)9-19(32(25,29)4)17-7-8-40-12-17)13-41-22-11-24(37)45-31(3)14-42-23(36)10-21(31)33(22,26)5/h7-8,12,15-16,19-22,26-29,35,38H,6,9-11,13-14H2,1-5H3/t16-,19-,20+,21-,22-,26+,27+,28+,29-,31+,32-,33+/m0/s1
SMILES CCC(C)C(O)C(=O)O[C@H]1[C@H](OC=O)[C@H]2C(=C3[C@H](O)C[C@@H](c4ccoc4)[C@@]31C)CO[C@H]1CC(=O)O[C@]3(C)COC(=O)C[C@@H]3[C@]12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeCipadessa baccifera Ref.
zoom in