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desulfo-7-deoxycylindrospermopsin

PropertiesImageOccurences in reactions
MNX_IDMNXM819380Image of MNXM819380
#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
formulaC15H22N5O3
charge1
mass320.17172
referencemetacycM:CPD-22144
InChIKeyQLZSSTRBQNLNHY-GATYQTQLSA-O
InChIInChI=1S/C15H21N5O3/c1-7-11-6-16-14-17-8(3-10(20(11)14)5-12(7)21)2-9-4-13(22)19-15(23)18-9/h4,7-8,10-12,21H,2-3,5-6H2,1H3,(H3,16,17,18,19,22,23)/p+1/t7-,8+,10+,11-,12+/m1/s1
SMILESC[C@H]1[C@@H](O)C[C@@H]2C[C@H](Cc3cc(=O)[nH]c(=O)[nH]3)NC3=[N+]2[C@@H]1CN3
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Similar chemical compounds in external resources
IdentifierDescription
metacyc.compound:CPD-22144
metacycM:CPD-22144
desulfo-7-deoxycylindrospermopsin