1-(2-acetamido-2-deoxy-α-D-glucopyranosyl)-1D-myo-inositol

Chemical Formula:

C₁₄H₂₅NO₁₁

Molecular Weight:

383.352 Daltons

Monoisotopic Mass:

383.1427606508 Daltons

SMILES:

CC(=O)NC2(C(OC1(C(O)C(O)C(O)C(O)C(O)1))OC(C(C2O)O)CO)

InChI:

1S/C14H25NO11/c1-3(17)15-5-7(19)6(18)4(2-16)25-14(5)26-13-11(23)9(21)8(20)10(22)12(13)24/h4-14,16,18-24H,2H2,1H3,(H,15,17)/t4-,5-,6-,7-,8-,9-,10+,11-,12-,13-,14-/m1/s1

InChIKey:

MRKTUVZZZRUSQR-JPUVNKLSSA-N

Synonyms

GlcNAc-Ins
1-D-myo-inosityl-2-acetamido-2-deoxy-α-D-glucopyranoside

Databases

MetaCyc: CPD1G-1

KEGG: C19784

PubChem (CID): 10452519

ChEBI: 52442

Reactome: 879332

Seed: cpd21029

MetaNetX: MNXM2062