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6,6-kestotetraose

MNXM10354 is deprecated and here replaced by MNXM1363483
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1363483 Image of MNXM1363483
referencechebi:64836
formulaC24H42O21
global charge0
mol weight666.579
InChIKeyOLSNVZYFDBPHML-DLQNOBSRSA-N
InChIInChI=1S/C24H42O21/c25-1-8-12(30)16(34)17(35)21(41-8)45-24(7-29)20(38)15(33)11(44-24)4-40-23(6-28)19(37)14(32)10(43-23)3-39-22(5-27)18(36)13(31)9(2-26)42-22/h8-21,25-38H,1-7H2/t8-,9-,10-,11-,12-,13-,14-,15-,16+,17-,18+,19+,20+,21-,22-,23-,24+/m1/s1
SMILESOC[C@H]1O[C@@](CO)(OC[C@H]2O[C@@](CO)(OC[C@H]3O[C@@](CO)(O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@@H]3O)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H]1O
MNX internals
InChI (mnx)InChI=1/C24H42O21/c25-1-8-12(30)16(34)17(35)21(41-8)45-24(7-29)20(38)15(33)11(44-24)4-40-23(6-28)19(37)14(32)10(43-23)3-39-22(5-27)18(36)13(31)9(2-26)42-22/h8-21,25-38H,1-7H2/t8-,9-,10-,11-,12-,13-,14-,15-,16+,17-,18+,19+,20+,21-,22-,23-,24+/m1/s1 Image of MNXM1363483
SMILES (mnx)[CH2:1]([C@@H:8]1[C@@H:12]([OH:30])[C@H:16]([OH:34])[C@@H:17]([OH:35])[C@@H:21]([O:45][C@@:24]2([CH2:7][OH:29])[C@@H:20]([OH:38])[C@H:15]([OH:33])[C@@H:11]([CH2:4][O:40][C@@:23]3([CH2:6][OH:28])[C@@H:19]([OH:37])[C@H:14]([OH:32])[C@@H:10]([CH2:3][O:39][C@@:22]4([CH2:5][OH:27])[C@@H:18]([OH:36])[C@H:13]([OH:31])[C@@H:9]([CH2:2][OH:26])[O:42]4)[O:43]3)[O:44]2)[O:41]1)[OH:25]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:64836
chebi:64836
OLSNVZYFDBPHML-DLQNOBSRSA-N 		6,6-kestotetraose
(Fruf)3 (Glc)1
beta-D-fructofuranosyl-(2->6)-beta-D-fructofuranosyl-(2->6)-beta-D-fructofuranosyl alpha-D-glucopyranoside

metacyc.compound:CPD-9550
metacycM:CPD-9550
OLSNVZYFDBPHML-DLQNOBSRSA-N 		6,6-kestotetraose