input word = C00029793

Metabolite InformationStructural formula
Name Bastadin 13
Formula C34H28Br4N4O8
Mw 935.8640655
CAS RN 134981-78-5
C_ID C00029793 ,
InChIKey KKHBVDPJYUKKMT-LTEVTRLRSA-N
InChICode InChI=1S/C34H28Br4N4O8/c35-21-3-1-18-6-8-40-33(45)25(41-47)12-19-10-23(37)32(24(38)11-19)50-30-16-20(9-22(36)31(30)44)13-26(42-48)34(46)39-7-5-17-2-4-28(27(43)14-17)49-29(21)15-18/h1-4,9-11,14-16,43-44,47-48H,5-8,12-13H2,(H,39,46)(H,40,45)/b41-25-,42-26+
SMILES O=C1NCCc2ccc(Br)c(c2)Oc2ccc(cc2O)CCNC(=O)/C(=N/O)Cc2cc(Br)c(O)c(c2)Oc2c(Br)cc(cc2Br)C/C1=N/O
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
--Ianthella basta Ref.
--Ianthella quadrangulata Ref.
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