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gamma-cyclodextrin

PropertiesImage
MNX_IDMNXM737988 Image of MNXM737988
referencechebi:495056
formulaC48H80O40
global charge0
mol weight1297.128
InChIKeyGDSRMADSINPKSL-SONXGWSZSA-N
InChIInChI=1S/C48H80O40/c49-1-9-33-17(57)25(65)41(73-9)82-34-10(2-50)75-43(27(67)19(34)59)84-36-12(4-52)77-45(29(69)21(36)61)86-38-14(6-54)79-47(31(71)23(38)63)88-40-16(8-56)80-48(32(72)24(40)64)87-39-15(7-55)78-46(30(70)22(39)62)85-37-13(5-53)76-44(28(68)20(37)60)83-35-11(3-51)74-42(81-33)26(66)18(35)58/h9-72H,1-8H2/t9-,10-,11-,12-,13-,14-,15-,16-,17-,18-,19-,20-,21-,22-,23-,24?,25-,26-,27-,28-,29-,30-,31-,32?,33-,34-,35-,36-,37-,38-,39-,40-,41-,42-,43-,44-,45-,46-,47-,48-/m1/s1
SMILESOC[C@H]1O[C@@H]2O[C@H]3[C@H](O)[C@@H](O)[C@@H](O[C@H]4[C@H](O)[C@@H](O)[C@@H](O[C@H]5[C@H](O)[C@@H](O)[C@@H](O[C@H]6[C@H](O)[C@@H](O)[C@@H](O[C@H]7[C@H](O)[C@@H](O)[C@@H](O[C@H]8[C@H](O)[C@@H](O)[C@@H](O[C@H]9[C@H](O)[C@@H](O)[C@@H](O[C@H]1[C@H](O)[C@H]2O)O[C@@H]9CO)O[C@@H]8CO)O[C@@H]7CO)O[C@@H]6CO)O[C@@H]5CO)O[C@@H]4CO)O[C@@H]3CO
MNX internals
InChI (mnx)InChI=1/C48H80O40/c49-1-9-33-17(57)25(65)41(73-9)82-34-10(2-50)75-43(27(67)19(34)59)84-36-12(4-52)77-45(29(69)21(36)61)86-38-14(6-54)79-47(31(71)23(38)63)88-40-16(8-56)80-48(32(72)24(40)64)87-39-15(7-55)78-46(30(70)22(39)62)85-37-13(5-53)76-44(28(68)20(37)60)83-35-11(3-51)74-42(81-33)26(66)18(35)58/h9-72H,1-8H2/t9-,10-,11-,12-,13-,14-,15-,16-,17-,18-,19-,20?,21?,22-,23-,24-,25-,26-,27-,28?,29?,30-,31-,32-,33-,34-,35-,36-,37-,38-,39-,40-,41-,42-,43-,44-,45-,46-,47-,48-/m1/s1 Image of MNXM737988
SMILES (mnx)[CH2:1]([C@H:9]1[C@@H:33]2[C@H:17]([OH:57])[C@@H:25]([OH:65])[C@H:41]([O:73]1)[O:82][C@@H:34]1[C@@H:10]([CH2:2][OH:50])[O:75][C@@H:43]([C@H:27]([OH:67])[C@H:19]1[OH:59])[O:84][C@@H:36]1[C@@H:12]([CH2:4][OH:52])[O:77][C@@H:45]([C@H:29]([OH:69])[C@H:21]1[OH:61])[O:86][C@@H:38]1[C@@H:14]([CH2:6][OH:54])[O:79][C@@H:47]([C@H:31]([OH:71])[C@H:23]1[OH:63])[O:88][C@@H:40]1[C@H:16]([CH2:8][OH:56])[O:80][C@@H:48]([CH:32]([OH:72])[CH:24]1[OH:64])[O:87][C@@H:39]1[C@H:15]([CH2:7][OH:55])[O:78][C@@H:46]([C@@H:30]([OH:70])[C@@H:22]1[OH:62])[O:85][C@@H:37]1[C@@H:13]([CH2:5][OH:53])[O:76][C@@H:44]([C@@H:28]([OH:68])[C@@H:20]1[OH:60])[O:83][C@@H:35]1[C@H:11]([CH2:3][OH:51])[O:74][C@@H:42]([C@@H:26]([OH:66])[C@@H:18]1[OH:58])[O:81]2)[OH:49]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)6
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:495056
chebi:495056
GDSRMADSINPKSL-SONXGWSZSA-N 		gamma-cyclodextrin
cyclomaltooctaose
cyclooctaamylose
gamma-CD

seed.compound:cpd24452
seedM:cpd24452
GDSRMADSINPKSL-SONXGWSZSA-N 		cyclooctaamylose
cyclooctapentylose
g-cyclodextrin
gamma-cyclodextrin
gamma-dextrin
ringdex c

sabiork.compound:22822
sabiorkM:22822
GDSRMADSINPKSL-SONXGWSZSA-N 		gamma-Cyclodextrin
hmdb:HMDB0029927
GDSRMADSINPKSL-SONXGWSZSA-N 		gamma-Cyclodextrin
.gama.-cyclodextrin
5,10,15,20,25,30,35,40-octakis(hydroxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29,32,34,37,39-hexadecaoxanonacyclo[36.2.2.2^{3,6}.2^{8,11}.2^{13,16}.2^{18,21}.2^{23,26}.2^{28,31}.2^{33,36}]hexapentacontane-41,42,43,44,45,46,47,48,49,50,51,52,53,54,55,56-hexadecol
Cyclomaltooctaose
Cyclooctaamylose
Cyclooctakis-(1->4)-(a-D-glucopyranose)
Cyclooctapentylose
Dexy pearl gamma-100
Ringdex c
Schardinger gamma-dextrin
cyclomalto-Octaose
g-Cyclodextrin
gamma-Dextrin
gamma-cyclodextrin

metacyc.compound:CPD-3783
metacycM:CPD-3783
GDSRMADSINPKSL-SONXGWSZSA-N 		gamma-cyclodextrin
cyclooctaamylose
cyclooctapentylose
g-cyclodextrin
gamma-dextrin
ringdex c

hmdb:HMDB29927
seedM:M_cpd24452 		secondary/obsolete/fantasy identifier