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Contact us: CRM@email.irandoc.ac.ir

Concept information

Preferred term

microcystbiopterin b  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C16H23N5O8

inchi

  • InChI=1S/C16H23N5O8/c1-5(28-15-11(25)12(27-2)10(24)7(4-22)29-15)9(23)6-3-18-13-8(19-6)14(26)21-16(17)20-13/h3,5,7,9-12,15,22-25H,4H2,1-2H3,(H3,17,18,20,21,26)/t5-,7+,9-,10+,11+,12-,15-/m0/s1

inchikey

  • ZQLTUOZZFIPZMO-DZFNSMJESA-N

mass

  • 413.387

monoisotopicmass

  • 413.15466

smiles

  • O=C1NC(=NC=2C1=NC(=CN2)[C@@H](O)[C@@H](O[C@H]3O[C@@H]([C@@H](O)[C@@H]([C@H]3O)OC)CO)C)N

subset

  • 2_STAR

synonym EXACT

  • 2-amino-6-[(1R,2S)-2-[(2S,3R,4S,5R,6R)-3,5-dihydroxy-6-(hydroxymethyl)-4-methoxyoxan-2-yl]oxy-1-hydroxypropyl]-3H-pteridin-4-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:200821

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