input word = C00015452

Metabolite InformationStructural formula
Name (3R,4aR,13bS)-rel-(+)-1,2,3,4,4a,13b-Hexahydro-3,9,11,13-tetrahydroxy-anthra[2,3-b]benzofuran-7,12-dione
UCT 1072M3
UCT 1O72M3
Formula C20H16O7
Mw 368.08960287
CAS RN 193402-66-3
C_ID C00015452 ,
InChIKey XHJKRNJSUIZZGE-SCAYQJEUNA-N
InChICode InChI=1S/C20H16O7/c21-7-1-2-9-13(5-7)27-14-6-11-17(20(26)16(9)14)19(25)15-10(18(11)24)3-8(22)4-12(15)23/h3-4,6-7,9,13,21-23,26H,1-2,5H2/t7-,9-,13-/m1/s1
SMILES c1(cc(c2c(c1)C(=O)c1c(C2=O)c(c2c(c1)O[C@H]1[C@H]2CC[C@H](C1)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeAspergillus sp. Ref.
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OrganismAspergillus sp.
ReferenceAsai,J. Antibiotics,52,(1999),1046