input word = C00046771

Metabolite InformationStructural formula
Name Hyrtiolide
(+)-Hyrtiolide
Formula C25H38O5
Mw 418.27192432
CAS RN 302324-59-0
C_ID C00046771 ,
InChIKey GAQSWPYYPSDAAV-BNVIJBFJNA-N
InChICode InChI=1S/C25H38O5/c1-22(2)8-6-9-23(3)14(22)7-10-24(4)15(23)12-17(27)25(5)16(24)11-13(26)18-19(25)21(29)30-20(18)28/h13-17,21,26-27,29H,6-12H2,1-5H3/t13-,14+,15-,16+,17-,21-,23+,24-,25-/m1/s1
SMILES O1C(=O)C2=C([C@@H]1O)[C@@]1([C@@H](C[C@H]2O)[C@]2([C@H](C[C@H]1O)[C@@]1([C@@H](CC2)C(CCC1)(C)C)C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Hyrtios erectus Ref.
--Hyrtios gumminae Ref.
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