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beta-D-Glcp-(1->4)-[alpha-D-GlcpA-(1->3)]-beta-D-Manp-(1->4)-alpha-D-Glcp

PropertiesImage
MNX_IDMNXM1128524 Image of MNXM1128524
referencechebi:166911
formulaC24H40O22
global charge0
mol weight680.562
InChIKeyLLQAUUVAFILAAL-CVMOQXMASA-N
InChIInChI=1S/C24H40O22/c25-1-4-7(28)8(29)13(34)22(41-4)44-17-6(3-27)42-24(43-16-5(2-26)40-21(39)12(33)11(16)32)15(36)18(17)45-23-14(35)9(30)10(31)19(46-23)20(37)38/h4-19,21-36,39H,1-3H2,(H,37,38)/t4-,5-,6-,7-,8+,9+,10+,11-,12-,13-,14-,15+,16-,17-,18-,19+,21+,22+,23+,24+/m1/s1
SMILESO=C(O)[C@H]1O[C@H](O[C@@H]2[C@H](O)[C@H](O[C@H]3[C@H](O)[C@@H](O)[C@@H](O)O[C@@H]3CO)O[C@H](CO)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O
MNX internals
InChI (mnx)InChI=1/C24H40O22/c25-1-4-7(28)8(29)13(34)22(41-4)44-17-6(3-27)42-24(43-16-5(2-26)40-21(39)12(33)11(16)32)15(36)18(17)45-23-14(35)9(30)10(31)19(46-23)20(37)38/h4-19,21-36,39H,1-3H2,(H,37,38)/t4-,5-,6-,7-,8+,9+,10+,11-,12-,13-,14-,15+,16-,17-,18-,19+,21+,22+,23+,24+/m1/s1 Image of MNXM1128524
SMILES (mnx)[CH2:1]([C@@H:4]1[C@@H:7]([OH:28])[C@H:8]([OH:29])[C@@H:13]([OH:34])[C@H:22]([O:44][C@@H:17]2[C@@H:6]([CH2:3][OH:27])[O:42][C@@H:24]([O:43][C@@H:16]3[C@@H:5]([CH2:2][OH:26])[O:40][C@H:21]([OH:39])[C@H:12]([OH:33])[C@H:11]3[OH:32])[C@@H:15]([OH:36])[C@H:18]2[O:45][C@@H:23]2[C@H:14]([OH:35])[C@@H:9]([OH:30])[C@H:10]([OH:31])[C@@H:19]([C:20](=[O:37])[OH:38])[O:46]2)[O:41]1)[OH:25]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:166911
chebi:166911
LLQAUUVAFILAAL-CVMOQXMASA-N
beta-D-Glcp-(1->4)-[alpha-D-GlcpA-(1->3)]-beta-D-Manp-(1->4)-alpha-D-Glcp
Glcbeta1-4(GlcAalpha1-4)Manbeta1-4Glcalpha
beta-D-Glc-(1->4)-[alpha-D-GlcA-(1->3)]-beta-D-Man-(1->4)-alpha-D-Glc
beta-D-glucopyranosyl-(1->4)-[alpha-D-glucopyranuronosyl-(1->3)]-beta-D-mannopyranosyl-(1->4)-alpha-D-glucopyranose
beta-D-glucosyl-(1->4)-[alpha-D-glucuronosyl-(1->3)]-beta-D-mannosyl-(1->4)-alpha-D-glucose