input word = C00023741

Metabolite InformationStructural formula
Name Cochlioquinone B
Formula C28H40O6
Mw 472.28248901
CAS RN 32450-26-3
C_ID C00023741 ,
InChIKey NTPNSKLZWVYKGK-DZKPJJIINA-N
InChICode InChI=1S/C28H40O6/c1-8-15(2)23(30)16(3)17-13-19(29)18-14-20-27(6)11-9-21(26(4,5)32)33-22(27)10-12-28(20,7)34-25(18)24(17)31/h13,15-16,20-22,32H,8-12,14H2,1-7H3/t15-,16-,20+,21+,22+,27+,28+/m0/s1
SMILES C1=C(C(=O)C2=C(C1=O)C[C@H]1[C@](O2)(CC[C@@H]2[C@@]1(CC[C@@H](O2)C(C)(C)O)C)C)[C@@H](C(=O)[C@H](CC)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiPleosporaceaeCochliobolus miyabeanus Ref.
FungiPleosporaceaeDrechslera dematioidea Ref.
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OrganismCochliobolus miyabeanus
ReferenceBarrow,J.C.S.Perkin I,(1972),2837-2839

Beljak,Ann.Ist.Super.Sanita,7,(1971),14-22

Carruthers,Chemical and X-ray Crystallographic Determination

Chem.Commun.,(1971),164-166