input word = C00051280

Metabolite InformationStructural formula
Name Limbatolide B
Formula C21H30O5
Mw 362.20932407
CAS RN 857677-27-1
C_ID C00051280
InChIKey IUOZYUJHWPQTCT-RLSVJGIONA-N
InChICode InChI=1S/C21H30O5/c1-13-8-10-21(3)15(18(22)23)6-5-7-16(21)20(13,2)11-9-14-12-17(25-4)26-19(14)24/h6,12-13,16-17H,5,7-11H2,1-4H3,(H,22,23)/t13-,16-,17?,20+,21-/m1/s1
SMILES COC1C=C(CC[C@@]2(C)[C@H](C)CC[C@]3(C)C(OC=O)=CCC[C@H]23)C(=O)O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--otostegia limbata Ref.
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