Details of the Drug

General Information of Drug (ID: DM7O1IW)

Drug Name

D-Mannose 1-Phosphate

Synonyms

D-Mannose 1-phosphate; Mannose 1-phosphate; mannose-1-P; D-mannose-1-phosphate; D-mannose 1-phosphates; CHEBI:35374; 27251-84-9; AC1LD8PO; delta-mannose-1-phosphate; Mannose 1-phosphoric acid; delta-mannose 1-phosphates; Epitope ID:145013; D-Mannopyranose-1-phosphate; D-Mannopyranose, 1-phosphate; SCHEMBL284741; alpha-delta-Mannose 1-phosphate; Mannose 1-phosphate-Mannopyranose; D-Mannose, 1-(dihydrogen phosphate); DB02867; D-mannopyranose 1-(dihydrogen phosphate); 1-(dihydrogen phosphate)-D-Mannopyranose; D-Mannopyranose, 1-(d

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)

260.14

Logarithm of the Partition Coefficient (xlogp)

-3.8

Rotatable Bond Count (rotbonds)

Hydrogen Bond Donor Count (hbonddonor)

Hydrogen Bond Acceptor Count (hbondacc)

Chemical Identifiers

Formula: C6H13O9P
IUPAC Name: [(3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] dihydrogen phosphate
Canonical SMILES: C([C@@H]1[C@H]([C@@H]([C@@H](C(O1)OP(=O)(O)O)O)O)O)O
InChI: InChI=1S/C6H13O9P/c7-1-2-3(8)4(9)5(10)6(14-2)15-16(11,12)13/h2-10H,1H2,(H2,11,12,13)/t2-,3-,4+,5+,6?/m1/s1
InChIKey: HXXFSFRBOHSIMQ-QTVWNMPRSA-N

Cross-matching ID

PubChem CID: 644175
ChEBI ID: CHEBI:35374
CAS Number: 27251-84-9
DrugBank ID: DB02867
TTD ID: D03AZI
INTEDE ID: DR2089

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Pseudomonas Phosphomannomutase/phosphoglucomutase (Pseudo algC)	TTLP3GX	ALGC_PSEAE	Inhibitor	[1]

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Drug-Metabolizing Enzyme (DME)

DME Name	DME ID	UniProt ID	MOA	REF
Phosphomannomutase 1 (PMM1)	DEJFMQ8	PMM1_HUMAN	Substrate	[2]
Phosphomannomutase 2 (PMM2)	DEBRX3L	PMM2_HUMAN	Substrate	[2]

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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.
2	The X-ray crystal structures of human alpha-phosphomannomutase 1 reveal the structural basis of congenital disorder of glycosylation type 1a. J Biol Chem. 2006 May 26;281(21):14918-26.