input word = C00017028

Metabolite InformationStructural formula
Name Cochiloquinone A
Luteoleersin
Formula C30H44O8
Mw 532.30361838
CAS RN 32450-25-2
C_ID C00017028 ,
InChIKey UWSYUCZPPVXEKW-YWIZOTLANA-N
InChICode InChI=1S/C30H44O8/c1-9-15(2)25(36-17(4)31)16(3)18-14-19(32)22-24(34)27-29(7)12-10-20(28(5,6)35)37-21(29)11-13-30(27,8)38-26(22)23(18)33/h14-16,20-21,24-25,27,34-35H,9-13H2,1-8H3/t15-,16-,20+,21+,24+,25+,27+,29-,30+/m0/s1
SMILES C1=C(C(=O)C2=C(C1=O)[C@H]([C@H]1[C@](O2)(CC[C@@H]2[C@@]1(CC[C@@H](O2)C(O)(C)C)C)C)O)[C@@H]([C@@H]([C@@H](C)CC)OC(=O)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiPleosporaceaeCochliobolus miyabeanus Ref.
FungiPleosporaceaeHelminthosporium leersii Ref.
FungiPleosporaceaeHelminthosporium sativum Ref.
PlantaePoaceaeLeersia virginica (Homolocenchrus virginicus) Ref.
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