input word = C00016831

Metabolite InformationStructural formula
Name Xanthoquinodin B
Xanthoquinodin B2
Formula C31H24O11
Mw 572.13186161
CAS RN 151063-29-5
C_ID C00016831 ,
InChIKey RRYHALMBLVCGCF-UHFFFAOYNA-N
InChICode InChI=1S/C31H24O11/c1-11-7-14-20(16(33)8-11)25(37)23-24(36)13-5-6-30(23,28(14)39)10-12-9-17(34)21-26(38)22-15(32)3-4-18(35)31(22,29(40)41-2)42-27(21)19(12)13/h5-9,13,18,32-35,37H,3-4,10H2,1-2H3/t13-,18+,30?,31-/m0/s1
SMILES c1(c2c(c3c(c1)C[C@]14C(=C(c5c(C1=O)cc(cc5O)C)O)C(=O)[C@H]3C=C4)O[C@@]1(C(=C(CC[C@H]1O)O)C2=O)C(=O)OC)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Humicola sp. FO-888 Ref.
zoom in