input word = C00046153

Metabolite InformationStructural formula
Name Milolide C
(-)-Milolide C
Formula C24H31ClO9
Mw 498.1656603
CAS RN 352335-85-4
C_ID C00046153 ,
InChIKey VMMRHHZYJGRXOJ-OUKAYGSONA-N
InChICode InChI=1S/C24H31ClO9/c1-9-13-7-14(30-11(3)26)22(5)15(31-12(4)27)8-16-23(6,34-16)18(22)19(28)24(33-13)10(2)21(29)32-20(24)17(9)25/h10,13-20,28H,1,7-8H2,2-6H3/t10-,13-,14-,15-,16+,17-,18+,19+,20-,22+,23+,24+/m0/s1
SMILES C1[C@@H]2[C@@]([C@H]3[C@@]([C@H]1OC(=O)C)([C@H](C[C@H]1C(=C)[C@@H]([C@H]4[C@]([C@@H]3O)([C@H](C(=O)O4)C)O1)Cl)OC(=O)C)C)(C)O2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Braiareum stechei Ref.
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