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lactose 6-phosphate

PropertiesImage
MNX_IDMNXM1106813 Image of MNXM1106813
referencechebi:79080
formulaC12H21O14P
global charge-2
mol weight420.26
InChIKeyITPHOIFCAFNCLL-QKKXKWKRSA-L
InChIInChI=1S/C12H23O14P/c13-1-3-10(7(16)8(17)11(19)24-3)26-12-9(18)6(15)5(14)4(25-12)2-23-27(20,21)22/h3-19H,1-2H2,(H2,20,21,22)/p-2/t3-,4-,5+,6+,7-,8-,9-,10-,11?,12+/m1/s1
SMILESO=P([O-])([O-])OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)C(O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O
MNX internals
InChI (mnx)InChI=1/C12H23O14P/c13-1-3-10(7(16)8(17)11(19)24-3)26-12-9(18)6(15)5(14)4(25-12)2-23-27(20,21)22/h3-19H,1-2H2,(H2,20,21,22)/t3-,4-,5+,6+,7-,8-,9-,10-,11?,12+/m1/s1 Image of MNXM1106813
SMILES (mnx)[CH:1]1([CH3:7])[C@@H:2]([CH3:8])[C@@H:4]([CH3:9])[C@H:6]([CH2:10][O@:13]2[O@@:14]([OH:19])[O@@:16]([OH:20])[O@@:18]([OH:21])[O@:17]([O:22][O:23][O:24]([OH:25])(=[O:26])[PH2:27])[O:15]2)[C@@H:5]([CH2:11][CH3:12])[CH2:3]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)12
in models (compartimentalized) 6
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:79080
chebi:79080
ITPHOIFCAFNCLL-QKKXKWKRSA-L 		lactose 6-phosphate
4-O-(6-O-phosphonato-beta-D-galactopyranosyl)-D-glucopyranose
6-O-phosphonato-beta-D-galactopyranosyl-(1->4)-D-glucopyranose
lactose 6-phosphate(2-)

kegg.compound:C05396
keggC:C05396
kegg.glycan:G10517
keggG:G10517
ITPHOIFCAFNCLL-QKKXKWKRSA-N 		Lactose 6'-phosphate
hmdb:HMDB0006789
ITPHOIFCAFNCLL-QKKXKWKRSA-N 		Lactose 6-phosphate
4-O-(6-O-Phosphono-b-D-galactopyranosyl)-D-glucopyranose
4-O-(6-O-Phosphono-beta-D-galactopyranosyl)-D-glucopyranose
Lactose 6'-phosphate
Lactose 6'-phosphoric acid
Lactose 6-phosphoric acid
lactose 6-phosphate
{[(2R,3R,4S,5R,6S)-3,4,5-trihydroxy-6-{[(2R,3S,4R,5R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}oxan-2-yl]methoxy}phosphonic acid

vmhM:lac6p
vmhM:lac6p
vmhmetabolite:lac6p
vmhmetabolite:lac6p
ITPHOIFCAFNCLL-QKKXKWKRSA-L 		Lactose 6-phosphate
{[(2R,3R,4S,5R,6S)-3,4,5-trihydroxy-6-{[(2R,3S,4R,5R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}oxan-2-yl]methoxy}phosphonic acid

bigg.metabolite:lac6p
biggM:lac6p
ITPHOIFCAFNCLL-QKKXKWKRSA-L 		Lactose-6-phosphate

seed.compound:cpd03194
seedM:cpd03194
ITPHOIFCAFNCLL-QKKXKWKRSA-L 		Lactose-6-phosphate
CPD-15973
Lac6p
Lactose 6-phosphate
alpha-lactose 6'-phosphate
lactose 6-phosphate

bigg.metabolite:HC01441
biggM:HC01441
ITPHOIFCAFNCLL-QKKXKWKRSA-L 		Lactose-6P

vmhM:HC01441
vmhM:HC01441
vmhmetabolite:HC01441
vmhmetabolite:HC01441
ITPHOIFCAFNCLL-QKKXKWKRSA-L 		Lactose-6P
{[(2R,3R,4S,5R,6S)-3,4,5-trihydroxy-6-{[(2R,3S,4R,5R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}oxan-2-yl]methoxy}phosphonic acid

metacyc.compound:CPD-15973
metacycM:CPD-15973
ITPHOIFCAFNCLL-QKKXKWKRSA-L 		lactose 6'-phosphate

CHEBI:28339
chebi:28339
ITPHOIFCAFNCLL-QKKXKWKRSA-N 		lactose 6'-phosphate
4-O-(6-O-phosphono-beta-D-galactopyranosyl)-D-glucopyranose
6-O-phosphono-beta-D-galactopyranosyl-(1->4)-D-glucopyranose
Lactose 6-phosphate

hmdb:HMDB06789
chebi:25003
chebi:6354
biggM:M_HC01441
biggM:M_lac6p
keggC:M_C05396
keggG:M_G10517
seedM:M_cpd03194
vmhM:M_HC01441
vmhM:M_lac6p 		secondary/obsolete/fantasy identifier