(2R,3S,4S,5R,6S)-2-({[(2S,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-[4-(2-nitroethyl)phenoxy]oxane-3,4,5-triol

AlkaPlorer ID: AK325280

Synonym: None

IUPAC Name: None

Structure

SMILES: O=[N+]([O-])CCC1=CC=C(O[C@@H]2O[C@H](CO[C@H]3O[C@H](CO)[C@@H](O)[C@@H]3O)[C@@H](O)[C@H](O)[C@H]2O)C=C1

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InChI: InChI=1S/C19H27NO12/c21-7-11-13(22)16(25)18(31-11)29-8-12-14(23)15(24)17(26)19(32-12)30-10-3-1-9(2-4-10)5-6-20(27)28/h1-4,11-19,21-26H,5-8H2/t11-,12-,13-,14-,15+,16+,17-,18+,19-/m1/s1

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InChIKey: FRYHJHNDJMHODU-CJQFLFKFSA-N

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Reference

SuperNatural Ⅲ: SN0093982-02

NPASS: NPC72311

Properties Information

Molecule Weight: 461.4200000000001

TPSA: 201.44

MolLogP: -2.852199999999997

Number of H-Donors: 6

Number of H-Acceptors: 12

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information