input word = C00024037

Metabolite InformationStructural formula
Name Scuterivulactone B
Formula C29H36O8
Mw 512.24101813
CAS RN 119614-69-6
C_ID C00024037 ,
InChIKey XDXHLLRNZWVGPH-MTXLVMOMNA-N
InChICode InChI=1S/C29H36O8/c1-17-20(31)11-12-21-27(17,4)22(36-25(33)19-9-7-6-8-10-19)13-26(3)28(21,5)23(35-18(2)30)14-29(37-26)15-24(32)34-16-29/h6-10,17,21-23H,11-16H2,1-5H3/t17-,21+,22+,23+,26+,27-,28+,29-/m1/s1
SMILES CC(=O)O[C@H]1C[C@@]2(COC(=O)C2)O[C@@]2(C)C[C@H](OC(=O)c3ccccc3)[C@@]3(C)[C@H](C)C(=O)CC[C@@H]3[C@@]12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeScutellaria rivularis Wall. Ref.
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