input word = C00051741

Metabolite InformationStructural formula
Name Cyclindrospermopsin
Formula C15H21N5O7S
Mw 415.11616879
CAS RN 143545-90-8
C_ID C00051741
InChIKey
InChICode InChI=1S/C14H18N5O7S.CH4/c20-11-4-10(17-14(22)18-11)12(21)9-3-6-1-8(26-27(23,24)25)2-7-5-15-13(16-9)19(6)7;/h4,6-9,12,21H,1-3,5H2,(H,15,16)(H2,17,18,20,22);1H4/t6-,7+,8+,9-,12-;/m1./s1
SMILES C1[C@H](C[C@H]2N3[C@@H]1CN=C3N[C@H](C2)[C@@H](O)c1cc(=O)[nH]c(=O)[nH]1)O[S](=O)(=O)=O.C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaNostocaceaeAphanizomenon flos-aquae Ref.
BacteriaNostocaceaeAphanizomenon ovalisporum Ref.
PlantaeEuphorbiaceaeAnabaena bergii Ref.
--Cylindrospermopsis raciborskii Ref.
--Raphidiopsis curvata Ref.
--Umezakia natans Ref.
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