input word = C00042259

Metabolite InformationStructural formula
Name Australin D
(-)-Australin D
Formula C24H38O6
Mw 422.26683895
CAS RN 863638-12-4
C_ID C00042259 ,
InChIKey SSSXYZDDZBJRQU-QUYDZBGUNA-N
InChICode InChI=1S/C24H38O6/c1-6-7-19(27)30-24(5)11-10-18-23(4,28)12-17(26)20-14(2)8-9-16(15(3)13-25)21(20)22(24)29-18/h15-16,18,20-22,25,28H,2,6-13H2,1,3-5H3/t15-,16+,18+,20+,21+,22+,23+,24+/m0/s1
SMILES [C@@H]12CC[C@@]([C@@H]([C@H]3[C@@H](C(=O)C[C@@]1(C)O)C(=C)CC[C@@H]3[C@@H](C)CO)O2)(C)OC(=O)CCC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Cladiella australis Ref.
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