Details of the Drug

General Information of Drug (ID: DMY590Q)

Drug Name

Glucosamine 6-Phosphate

Synonyms

glucosamine 6-phosphate; glucosamine-6-phosphate; D-glucosamine phosphate; D-glucosamine 6-phosphate; 2-amino-2-deoxy-6-O-phosphono-alpha-D-glucopyranose; GlcN-6-P; 1moq; Glucose-6-phosphorate; bmse000189; AC1L96WN; SCHEMBL4363568; CHEBI:15873; XHMJOUIAFHJHBW-UKFBFLRUSA-N; ZINC4097103; alpha-D-Glucosamine 6-phosphoric acid; DB02657; alpha-D-glucosamine 6-(dihydrogen phosphate); 2-amino-2-deoxy-alpha-D-glucopyranose 6-(dihydrogen phosphate); WURCS=2.0/1,1,0/[a2122h-1a_1-5_2*N_6*OPO/3O/3=O]/1/

Indication

Disease Entry	ICD 11	Status	REF
Discovery agent	N.A.	Investigative	[1]
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Drug Type

Small molecular drug

Structure

3D MOL

2D MOL

#Ro5 Violations (Lipinski): 2

Molecular Weight (mw)

259.149

Logarithm of the Partition Coefficient (xlogp)

-6.8

Rotatable Bond Count (rotbonds)

Hydrogen Bond Donor Count (hbonddonor)

Hydrogen Bond Acceptor Count (hbondacc)

Chemical Identifiers

Formula: C6H14NO8P
IUPAC Name: [(2R,3S,4R,5R,6S)-5-amino-3,4,6-trihydroxyoxan-2-yl]methyl dihydrogen phosphate
Canonical SMILES: C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O)N)O)O)OP(=O)(O)O
InChI: InChI=1S/C6H14NO8P/c7-3-5(9)4(8)2(15-6(3)10)1-14-16(11,12)13/h2-6,8-10H,1,7H2,(H2,11,12,13)/t2-,3-,4-,5-,6+/m1/s1
InChIKey: XHMJOUIAFHJHBW-UKFBFLRUSA-N

Cross-matching ID

PubChem CID: 439217
ChEBI ID: CHEBI:15873
CAS Number: 3616-42-0
DrugBank ID: DB02657
TTD ID: D0Y8PY

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Bacterial Glucosamine-6-phosphate synthase (Bact glmS)	TTC67I0	GLMS_ECOLI	Inhibitor	[1]

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Molecular Interaction Atlas (MIA)

MIA Detail

Jump to Detail Molecular Interaction Atlas of This Drug

References

1	How many drug targets are there Nat Rev Drug Discov. 2006 Dec;5(12):993-6.