alpha-D-mannose 6-phosphate (CHEBI:43896)

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CHEBI:43896 - α-D-mannose 6-phosphate

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ChEBI Name	α-D-mannose 6-phosphate

ChEBI ID	CHEBI:43896

ChEBI ASCII Name	alpha-D-mannose 6-phosphate

Definition	The α-anomer of D-mannose 6-phosphate.

Stars	This entity has been manually annotated by the ChEBI Team.

Secondary ChEBI IDs	CHEBI:43894, CHEBI:12328

Supplier Information	ChemicalBook:CB7399440, eMolecules:484241, ZINC000000084153

Download	Molfile XML SDF

more structures >>

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Marvin 12040716323D

29 29 0 0 1 0 999 V2000

-3.0651 -1.0948 2.1409 P 0 0 1 0 0 0 0 0 0 0 0 0

-2.1940 -0.4874 1.1399 O 0 0 0 0 0 0 0 0 0 0 0 0

-4.2323 -0.2833 2.3630 O 0 0 0 0 0 0 0 0 0 0 0 0

-3.4624 -2.4067 1.6885 O 0 0 0 0 0 0 0 0 0 0 0 0

-2.3657 -1.2307 3.3946 O 0 0 0 0 0 0 0 0 0 0 0 0

-1.0232 -0.9832 0.7170 C 0 0 0 0 0 0 0 0 0 0 0 0

-0.2996 -0.1343 -0.3580 C 0 0 2 0 0 0 0 0 0 0 0 0

1.0357 -0.8383 -0.7591 C 0 0 2 0 0 0 0 0 0 0 0 0

-0.0880 1.1927 0.1722 O 0 0 0 0 0 0 0 0 0 0 0 0

2.0022 0.0957 -1.5291 C 0 0 1 0 0 0 0 0 0 0 0 0

0.7548 -2.0113 -1.5236 O 0 0 0 0 0 0 0 0 0 0 0 0

0.7256 2.0921 -0.6073 C 0 0 1 0 0 0 0 0 0 0 0 0

2.1309 1.4792 -0.8376 C 0 0 1 0 0 0 0 0 0 0 0 0

3.2755 -0.5388 -1.6432 O 0 0 0 0 0 0 0 0 0 0 0 0

0.1036 2.4383 -1.8449 O 0 0 0 0 0 0 0 0 0 0 0 0

2.8064 1.3473 0.4142 O 0 0 0 0 0 0 0 0 0 0 0 0

-4.1464 0.5227 2.7056 H 0 0 0 0 0 0 0 0 0 0 0 0

-3.7858 -3.0009 2.2500 H 0 0 0 0 0 0 0 0 0 0 0 0

-0.3436 -1.0749 1.5721 H 0 0 0 0 0 0 0 0 0 0 0 0

-1.1790 -1.9836 0.2979 H 0 0 0 0 0 0 0 0 0 0 0 0

-0.9488 -0.0512 -1.2366 H 0 0 0 0 0 0 0 0 0 0 0 0

1.5589 -1.1637 0.1458 H 0 0 0 0 0 0 0 0 0 0 0 0

1.6229 0.2372 -2.5450 H 0 0 0 0 0 0 0 0 0 0 0 0

1.6156 -2.4628 -1.6442 H 0 0 0 0 0 0 0 0 0 0 0 0

0.8249 3.0211 -0.0417 H 0 0 0 0 0 0 0 0 0 0 0 0

2.7315 2.1466 -1.4608 H 0 0 0 0 0 0 0 0 0 0 0 0

3.8380 0.0868 -2.1443 H 0 0 0 0 0 0 0 0 0 0 0 0

-0.7617 2.8305 -1.6042 H 0 0 0 0 0 0 0 0 0 0 0 0

2.8691 2.2555 0.7778 H 0 0 0 0 0 0 0 0 0 0 0 0

1 2 1 0 0 0 0

1 3 1 0 0 0 0

1 4 1 0 0 0 0

1 5 2 0 0 0 0

2 6 1 0 0 0 0

7 6 1 0 0 0 0

7 8 1 0 0 0 0

7 9 1 0 0 0 0

8 10 1 0 0 0 0

8 11 1 0 0 0 0

9 12 1 0 0 0 0

10 13 1 0 0 0 0

10 14 1 0 0 0 0

12 15 1 0 0 0 0

13 16 1 0 0 0 0

12 13 1 0 0 0 0

3 17 1 0 0 0 0

4 18 1 0 0 0 0

6 19 1 0 0 0 0

6 20 1 0 0 0 0

7 21 1 0 0 0 0

8 22 1 0 0 0 0

10 23 1 0 0 0 0

11 24 1 0 0 0 0

12 25 1 0 0 0 0

13 26 1 0 0 0 0

14 27 1 0 0 0 0

15 28 1 0 0 0 0

16 29 1 0 0 0 0

M END): 18 ms

reading 29 atoms

ModelSet: haveSymmetry:false haveUnitcells:false haveFractionalCoord:false

1 model in this collection. Use getProperty "modelInfo" or getProperty "auxiliaryInfo" to inspect them.

Default Van der Waals type for model set to Babel

29 atoms created

ModelSet: not autobonding; use forceAutobond=true to force automatic bond creation

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Formula

C6H13O9P

Net Charge

Average Mass

260.13578

Monoisotopic Mass

260.02972

InChI

InChI=1S/C6H13O9P/c7-3-2(1-14-16(11,12)13)15-6(10)5(9)4(3)8/h2-10H,1H2,(H2,11,12,13)/t2-,3-,4+,5+,6+/m1/s1

InChIKey

NBSCHQHZLSJFNQ-PQMKYFCFSA-N

SMILES

O[C@H]1O[C@H](COP(O)(O)=O)[C@@H](O)[C@H](O)[C@@H]1O

Roles Classification
Biological Role(s):	epitope The biological role played by a material entity when bound by a receptor of the adaptive immune system. Specific site on an antigen to which an antibody binds. fundamental metabolite Any metabolite produced by all living cells. (via D-mannose 6-phosphate )

View more via ChEBI Ontology

ChEBI Ontology
Outgoing	α-D-mannose 6-phosphate (CHEBI:43896) has functional parent α-D-mannose (CHEBI:28729) α-D-mannose 6-phosphate (CHEBI:43896) has role epitope (CHEBI:53000) α-D-mannose 6-phosphate (CHEBI:43896) is a D-mannopyranose 6-phosphate (CHEBI:48066) α-D-mannose 6-phosphate (CHEBI:43896) is conjugate acid of α-D-mannose 6-phosphate(2−) (CHEBI:60332)

Incoming	α-D-Manp-(1→2)-α-D-Manp6P (CHEBI:147846) has functional parent α-D-mannose 6-phosphate (CHEBI:43896) α-D-Manp6P-(1→2)-D-Manp (CHEBI:147929) has functional parent α-D-mannose 6-phosphate (CHEBI:43896) α-D-Manp6P-(1→3)-α-D-Manp (CHEBI:153538) has functional parent α-D-mannose 6-phosphate (CHEBI:43896) α-D-Manp6P-(1→6)-α-D-Manp (CHEBI:153487) has functional parent α-D-mannose 6-phosphate (CHEBI:43896) α-D-Manp6P-(1→6)-D-Manp (CHEBI:150738) has functional parent α-D-mannose 6-phosphate (CHEBI:43896) 6-phospho-α-D-mannoside (CHEBI:138581) has functional parent α-D-mannose 6-phosphate (CHEBI:43896) α-D-mannose 6-phosphate(2−) (CHEBI:60332) is conjugate base of α-D-mannose 6-phosphate (CHEBI:43896)

IUPAC Name

α-D-mannopyranose 6-(dihydrogen phosphate)

Synonyms	Sources
(6P)Mana	ChEBI
(6P)Manα	ChEBI
6-H2PO3Manα	ChEBI
6-O-phosphono-α-D-mannopyranose	IUPAC
6-O-phosphono-α-D-mannose	ChEBI
α-D-mannopyranose, 6-(dihydrogen phosphate)	ChEBI
ALPHA-D-MANNOSE-6-PHOSPHATE	PDBeChem
Man6P	ChEBI

Manual Xrefs	Databases
DB02900	DrugBank
M6P	PDBeChem
View more database links

Registry Numbers	Types	Sources
2334882	Beilstein Registry Number	Beilstein
2334882	Reaxys Registry Number	Reaxys

Citations	Types	Sources
19443021	PubMed citation	Europe PMC
25568069	PubMed citation	Europe PMC
26503547	PubMed citation	Europe PMC
31537530	PubMed citation	Europe PMC

Last Modified

20 April 2024

CHEBI:43896 - α-D-mannose 6-phosphate

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