supinanitriloside F

AlkaPlorer ID: AK107173

Synonym: None

IUPAC Name: (2E)-2-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethylidene]butanenitrile

Structure

SMILES: CC/C(C#N)=C\O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

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InChI: InChI=1S/C11H17NO6/c1-2-6(3-12)5-17-11-10(16)9(15)8(14)7(4-13)18-11/h5,7-11,13-16H,2,4H2,1H3/b6-5+/t7-,8-,9+,10-,11-/m1/s1

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InChIKey: UXPWWPWJKKPXCB-DGWUHCKDSA-N

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Source

Properties Information

Molecule Weight: 259.258

TPSA: 123.17000000000002

MolLogP: -1.3796200000000003

Number of H-Donors: 4

Number of H-Acceptors: 7

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information