input word = C00016829

Metabolite InformationStructural formula
Name Xanthoquinodin A
Xanthoquinodin A3
Formula C31H24O11
Mw 572.13186161
CAS RN 150999-73-8
C_ID C00016829 ,
InChIKey JUSHCXMJWBJGNO-UHFFFAOYNA-N
InChICode InChI=1S/C31H24O11/c1-12-7-15-22(16(32)8-12)27(37)24-25(35)14-5-6-30(24,28(15)38)10-13-9-18-23(26(36)21(13)14)17(33)11-31(42-18,29(39)40-2)19-3-4-20(34)41-19/h5-9,14,19,32,36-37H,3-4,10-11H2,1-2H3/t14-,19-,30-,31-/m0/s1
SMILES C1[C@](Oc2c(C1=O)c(c1c(c2)C[C@@]23C(=C(c4c(C2=O)cc(cc4O)C)O)C(=O)[C@H]1C=C3)O)([C@H]1OC(=O)CC1)C(=O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Humicola sp. FO-888 Ref.
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OrganismHumicola sp. FO-888
ReferenceTabata,J.Antibiotics 46,(1993),749