input word = C00023740

Metabolite InformationStructural formula
Name Cochliohydroquinone A
Alboleersin
Formula C30H46O8
Mw 534.31926845
CAS RN 41059-86-3
C_ID C00023740 ,
InChIKey UQNKLYUSWJMMQQ-TXJFZKTLNA-N
InChICode InChI=1S/C30H46O8/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/h14-16,20-21,24-25,27,32-35H,9-13H2,1-8H3/t15-,16-,20-,21-,24-,25+,27-,29+,30-/m1/s1
SMILES c1c(c(c2c(c1O)[C@H]([C@H]1[C@](O2)(CC[C@@H]2[C@@]1(CC[C@@H](O2)C(C)(C)O)C)C)O)O)[C@@H](C)[C@@H](OC(=O)C)[C@@H](CC)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiPleosporaceaeCochliobolus miyabeanus Ref.
FungiPleosporaceaeDrechslera oryzae Ref.
PlantaePoaceaeLeersia virginica Ref.
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