input word = C00024080

Metabolite InformationStructural formula
Name Foetidinol
Formula C27H40O5
Mw 444.28757439
CAS RN 158204-38-7
C_ID C00024080 ,
InChIKey NYANQAGYZSJBHG-VSYGWIHWNA-N
InChICode InChI=1S/C27H40O5/c1-14-10-15(28)21(31)27(32)12-24(5)17-7-6-16-22(2,3)18(29)8-9-25(16)13-26(17,25)19(30)11-23(24,4)20(14)27/h7,14,16,18-21,29-32H,6,8-13H2,1-5H3/t14-,16+,18+,19+,20-,21+,23-,24+,25-,26+,27-/m1/s1
SMILES C1(=O)C[C@H]([C@H]2[C@@]([C@H]1O)(C[C@@]1([C@@]2(C[C@@H]([C@]23C1=CC[C@@H]1[C@@]2(CC[C@@H](C1(C)C)O)C3)O)C)C)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRanunculaceaeCimicifuga foetida L. Ref.
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