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3-amino-3-deoxy-D-glucopyranose

AlkaPlorer ID: AK074918

Synonym: 'D-kanosamine', 'kanosamine', 'Kanosamine'

IUPAC Name: (3R,4S,5S,6R)-4-amino-6-(hydroxymethyl)oxane-2,3,5-triol

Structure

SMILES: N[C@H]1[C@H](O)[C@@H](CO)OC(O)[C@@H]1O

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InChI: InChI=1S/C6H13NO5/c7-3-4(9)2(1-8)12-6(11)5(3)10/h2-6,8-11H,1,7H2/t2-,3+,4-,5-,6?/m1/s1

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InChIKey: BQCCAEOLPYCBAE-CBPJZXOFSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Bacillus cereus Bacillus Bacillaceae Bacillales Bacilli Bacillota None Bacteria

Properties Information

Molecule Weight: 179.17200000000005

TPSA？: 116.17000000000002

MolLogP？: -3.2549999999999994

Number of H-Donors: 5

Number of H-Acceptors: 6

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Poria Poria GI 18.4 % 10.1002/ps.2063
Poria Poria GI 26.7 % 10.1002/ps.2063
Trametes versicolor Trametes versicolor GI 0.0 % 10.1002/ps.2063
Trametes versicolor Trametes versicolor GI 14.9 % 10.1002/ps.2063

Metabolism Information

AKRT ID Reaction Reaction Link ID
AKRT020469 N[C@H]1[C@H](O)[C@@H](CO)OC(O)[C@@H]1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O>>N[C@H]1[C@H](O)[C@@H](COP(=O)(O)O)OC(O)[C@@H]1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O None
AKRT020470 N[C@H]1[C@H](O)[C@@H](CO)OC(O)[C@@H]1O>>N[C@H]1[C@H](O)[C@@H](COP(=O)(O)O)OC(O)[C@@H]1O RXN-9581
AKRT020472 N[C@H]1[C@H](O)[C@@H](CO)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@@H]1O>>N[C@H]1[C@H](O)[C@@H](CO)OC(O)[C@@H]1O RXN-9580
AKRT020477 N[C@H]1[C@H](O)[C@@H](COP(=O)(O)O)OC(O)[C@@H]1O>>N[C@H]1[C@H](O)[C@@H](CO)OC(O)[C@@H]1O RXN8J2-138