input word = C00030585

Metabolite InformationStructural formula
Name Kalidiunin
(+)-Kalidiunin
Formula C31H50O5
Mw 502.36582471
CAS RN 958636-13-0
C_ID C00030585 ,
InChIKey QCYVRROBMNKQIM-ISBHAVCNNA-N
InChICode InChI=1S/C31H50O5/c1-26(18-32)13-15-31(25(35)36-6)16-14-29(4)20(21(31)17-26)7-8-23-27(2)11-10-24(34)28(3,19-33)22(27)9-12-30(23,29)5/h7,21-24,32-34H,8-19H2,1-6H3/t21-,22+,23+,24-,26+,27-,28-,29+,30+,31-/m0/s1
SMILES C1[C@@H]([C@]([C@H]2[C@](C1)([C@@H]1[C@@](CC2)([C@]2(C(=CC1)[C@H]1[C@@](CC2)(CC[C@@](C1)(C)CO)C(=O)OC)C)C)C)(CO)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeChenopodiaceaeKalidium foliatum Ref.
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