4-Hydroxy-2-methyl-2-butenoic acid; (Z)-form, Nitrile, 4-O-β-D-glucopyranoside 

AlkaPlorer ID: AK301455

Synonym: Multifidin, Rhodiocyanoside A

IUPAC Name: None

Structure

SMILES: C/C(C#N)=C/COC1OC(CO)C(O)C(O)C1O

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InChI: InChI=1S/C11H17NO6/c1-6(4-12)2-3-17-11-10(16)9(15)8(14)7(5-13)18-11/h2,7-11,13-16H,3,5H2,1H3/b6-2-

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InChIKey: ZMELGIPFIBWPHX-KXFIGUGUSA-N

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Reference

CAS: 168433-86-1

Properties Information

Molecule Weight: 259.258

TPSA: 123.17000000000002

MolLogP: -1.7272200000000006

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