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Chemistry, part 2

Content language

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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > organic tricyclic compound > organic heterotricyclic compound > 12beta-deoxy-deoxysaxitoxin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic polycyclic compound > organic tricyclic compound > organic heterotricyclic compound > 12beta-deoxy-deoxysaxitoxin
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > organic tricyclic compound > organic heterotricyclic compound > 12beta-deoxy-deoxysaxitoxin
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > organic tricyclic compound > organic heterotricyclic compound > 12beta-deoxy-deoxysaxitoxin
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > organic heterotricyclic compound > 12beta-deoxy-deoxysaxitoxin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > organic heterotricyclic compound > 12beta-deoxy-deoxysaxitoxin
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > organic heterotricyclic compound > 12beta-deoxy-deoxysaxitoxin

Preferred term

12beta-deoxy-deoxysaxitoxin  

Type

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

Broader concept

charge

  • 0

formula

  • C9H16N6O

has_role

inchi

  • InChI=1S/C9H16N6O/c1-4-6-9(14-7(10)13-6)5(16)2-3-15(9)8(11)12-4/h4-6,16H,2-3H2,1H3,(H2,11,12)(H3,10,13,14)/t4-,5+,6-,9+/m0/s1

inchikey

  • QREWPEMPVQOBAA-SOVPELCUSA-N

mass

  • 224.268

monoisotopicmass

  • 224.13856

smiles

  • O[C@H]1[C@@]23N(C(=N[C@H]([C@@H]2N=C(N3)N)C)N)CC1

subset

  • 2_STAR

synonym EXACT

  • (3aS,4S,10R,10aS)-2,6-diamino-4-methyl-1,3a,4,8,9,10-hexahydropyrrolo[1,2-c]purin-10-ol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:214708

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