input word = C00045701

Metabolite InformationStructural formula
Name Briaexcavatolide M
(-)-Briaexcavatolide M
Formula C24H31ClO9
Mw 498.1656603
CAS RN 334831-91-3
C_ID C00045701 ,
InChIKey LOUKFFGGKRJYCC-YDBRZTJONA-N
InChICode InChI=1S/C24H31ClO9/c1-10-17-20(32-13(4)27)24(30)11(2)22(29)33-16(24)8-14(9-25)6-7-15(28)23(17,5)21-19(34-21)18(10)31-12(3)26/h6-8,10-11,15-21,28,30H,9H2,1-5H3/b7-6+,14-8+/t10-,11+,15+,16+,17-,18-,19+,20+,21+,23-,24-/m1/s1
SMILES [C@H]12[C@@H]([C@@H]([C@H]3[C@]([C@H]1O2)([C@H](/C=C/C(=C/[C@H]1[C@]([C@H]3OC(=O)C)(O)[C@H](C(=O)O1)C)/CCl)O)C)C)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Briareum excavatum Ref.
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