input word = C00050982

Metabolite InformationStructural formula
Name Isopropyl idenekirenol
Formula C23H38O4
Mw 378.2770097
CAS RN 89354-33-6
C_ID C00050982
InChIKey RFVIIASIYASSNN-LJNNXCFVNA-N
InChICode InChI=1S/C23H38O4/c1-20(2)26-13-19(27-20)21(3)9-8-17-15(10-21)6-7-18-22(4,14-24)11-16(25)12-23(17,18)5/h10,16-19,24-25H,6-9,11-14H2,1-5H3/t16-,17-,18-,19+,21+,22+,23+/m1/s1
SMILES CC1(C)OC[C@@H]([C@]2(C)C=C3CC[C@@H]4[C@](C)(CO)C[C@@H](O)C[C@@]4(C)[C@@H]3CC2)O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Siegesbeckia orientalis Ref.
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