input word = C00042648

Metabolite InformationStructural formula
Name Klyxumine B
Formula C24H40O7
Mw 440.27740363
CAS RN 845298-26-2
C_ID C00042648 ,
InChIKey ULRJPFSIVFAPGP-KDQHUKAPNA-N
InChICode InChI=1S/C24H40O7/c1-13(2)16-9-12-23(6,30-14(3)25)18-17(16)21-22(5,28)10-8-11-24(7,31-15(4)26)20(27)19(18)29-21/h13,16-21,27-28H,8-12H2,1-7H3/t16-,17-,18+,19+,20+,21-,22-,23-,24-/m1/s1
SMILES CC(=O)O[C@]1(C)CC[C@H](C(C)C)[C@@H]2[C@H]1[C@@H]1O[C@H]2[C@](C)(O)CCC[C@@](C)(OC(C)=O)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Klyxum flaccidum Ref.
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