MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

Feedback

beta-D-mannopyranosyl-(1->2)-D-mannopyranose

	Properties	Image
MNX_ID	MNXM44062
reference	chebi:62037
formula	C₁₂H₂₂O₁₁
global charge	0
mol weight	342.297
InChIKey	HIWPGCMGAMJNRG-FZFXURTHSA-N
InChI	InChI=1S/C12H22O11/c13-1-3-6(16)8(18)10(11(20)21-3)23-12-9(19)7(17)5(15)4(2-14)22-12/h3-20H,1-2H2/t3-,4-,5-,6-,7+,8+,9+,10+,11?,12+/m1/s1
SMILES	OC[C@H]1O[C@@H](O[C@@H]2C(O)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O

MNX internals

InChI (mnx)	InChI=1/C12H22O11/c13-1-3-6(16)8(18)10(11(20)21-3)23-12-9(19)7(17)5(15)4(2-14)22-12/h3-20H,1-2H2/t3-,4-,5-,6-,7+,8+,9+,10+,11?,12+/m1/s1
SMILES (mnx)	[CH2:1]([C@@H:3]1[C@@H:6]([OH:16])[C@H:8]([OH:18])[C@H:10]([O:23][C@H:12]2[C@@H:9]([OH:19])[C@@H:7]([OH:17])[C@H:5]([OH:15])[C@@H:4]([CH2:2][OH:14])[O:22]2)[CH:11]([OH:20])[O:21]1)[OH:13]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	3
in models (compartimentalized)	0

Similar chemical compounds in external resources
Identifier	Description
CHEBI:62037 chebi:62037 HIWPGCMGAMJNRG-FZFXURTHSA-N	beta-D-mannopyranosyl-(1->2)-D-mannopyranose 2-O-beta-D-mannopyranosyl-D-mannopyranose 2beta-Man WURCS=2.0/2,2,1/[a1122h-1x_1-5][a1122h-1b_1-5]/1-2/a2-b1 beta-D-Man-(1->2)-D-Man beta-D-Manp-(1-2)-D-Manp beta-D-Manp-(1->2)-D-Manp
seed.compound:cpd36250 seedM:cpd36250 HIWPGCMGAMJNRG-FZFXURTHSA-N	CPD-18909
metacyc.compound:CPD-18909 metacycM:CPD-18909 HIWPGCMGAMJNRG-FZFXURTHSA-N	beta-1,2-D-mannobiose 2-O-beta-D-mannopyranosyl-D-mannopyranose beta-D-mannopyranosyl-(1->2)-D-mannopyranose
kegg.compound:C21336 keggC:C21336 HIWPGCMGAMJNRG-FZFXURTHSA-N	beta-1,2-Mannobiose beta-D-Mannopyranosyl-(1->2)-D-mannopyranose
keggC:M_C21336 seedM:M_cpd36250	secondary/obsolete/fantasy identifier