inositol hexanitrate Report issue

Small molecule Experimental

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Chemistry

Mol. Mass

450.1412

ALogP

Missing data

Rule of 5

Missing data

Rule of 3

Missing data
Details
  • SMILES: [O-][N+](=O)O[C@@H]1[C@H](O[N+]([O-])=O)[C@H](O[N+]([O-])=O)[C@@H](O[N+]([O-])=O)[C@H](O[N+]([O-])=O)[C@H]1O[N+]([O-])=O
  • InChIKey: VAASRZPDHFMMMC-GPIVLXJGSA-N
    1S/C6H6N6O18/c13-7(14)25-1-2(26-8(15)16)4(28-10(19)20)6(30-12(23)24)5(29-11(21)22)3(1)27-9(17)18/h1-6H/t1-,2-,3-,4+,5-,6-
  • Chirality: None
  • Inorganic: Missing data
  • Polymer: Missing data

Sources

686T63H73D   NCATS
inositol hexanitrate *

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Data collection and curation is an ongoing process for CDEK - if you notice any information here to be missing or incorrect, please let us know! When possible, please include a source URL (we verify all data prior to inclusion).

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