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CHEBI:59380 - GPL-26

ChEBI IDCHEBI:59380
ChEBI NameGPL-26
Stars
DefinitionA glycopeptidolipid antigen from clinically prominent members of the Mycobacterium avium serocomplex.
Last Modified15 December 2016
SubmitterSteve
DownloadsMolfile
FormulaC92H160N4O33
Net Charge0
Average Mass1850.287
Monoisotopic Mass1849.09648
SMILESCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](C(=O)N[C@H](C)C(=O)N[C@@H](C)COC1O[C@@H](C)[C@H](OC)[C@@H](OC)[C@H]1O)[C@@H](C)OC1O[C@@H](C)[C@@H](O)[C@@H](O)[C@H]1O[C@@H]1O[C@@H](C)[C@H](O)[C@@H](O[C@@H]2O[C@@H](C)[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[C@@H]4O[C@@H](C)[C@@H](OC)[C@@H](O)[C@@H]4OC)[C@H](O)[C@H]3O)[C@@H](O)[C@@H]2OC)[C@H]1O
InChIInChI=1S/C92H160N4O33/c1-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-39-40-44-47-60(97)49-62(98)95-61(48-59-45-42-41-43-46-59)84(109)96-63(85(110)94-52(3)83(108)93-51(2)50-118-87-72(107)77(115-12)75(114-11)58(9)122-87)53(4)119-92-81(66(101)64(99)54(5)121-92)128-89-71(106)76(65(100)55(6)120-89)126-90-80(117-14)70(105)74(57(8)124-90)125-88-68(103)67(102)78(82(129-88)86(111)112)127-91-79(116-13)69(104)73(113-10)56(7)123-91/h41-43,45-46,51-58,60-61,63-82,87-92,97,99-107H,15-40,44,47-50H2,1-14H3,(H,93,108)(H,94,110)(H,95,98)(H,96,109)(H,111,112)/t51-,52+,53+,54-,55-,56-,57-,58-,60?,61+,63+,64+,65-,66+,67+,68+,69+,70+,71+,72+,73+,74+,75-,76+,77-,78-,79-,80-,81+,82-,87?,88+,89-,90-,91-,92?/m0/s1
InChIKeyUVDPDRXNCSPPTD-RDKSZZMGSA-N
Species of MetaboliteComponentSourceComments
Mycobacterium avium (ncbitaxon:1764) - PubMed (2476400)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
antigen  Any substance that stimulates an immune response in the body, such as through antibody production or by presentation to a T-cell receptor after binding to a major histocompability complex (MHC).
ChEBI Ontology
Outgoing Relation(s)
GPL-26 (CHEBI:59380) has role antigen (CHEBI:59132)
GPL-26 (CHEBI:59380) is a glycopeptidolipid (CHEBI:59375)
IUPAC Name 
(2S,3S,4R,5R,6R)-6-{[(2S,3S,4R,5S,6S)-6-{[(2S,3R,4R,5S,6S)-2-{[(3R,4R,5S,6S)-4,5-dihydroxy-2-{[(2R,3R)-4-{[(2R)-1-{[(2S)-1-{[(3R,4S,5S,6S)-3-hydroxy-4,5-dimethoxy-6-methyloxan-2-yl]oxy}propan-2-yl]amino}-1-oxopropan-2-yl]amino}-3-({(2R)-2-[(3-hydroxydotriacontanoyl)amino]-3-phenylpropanoyl}amino)-4-oxobutan-2-yl]oxy}-6-methyloxan-3-yl]oxy}-3,5-dihydroxy-6-methyloxan-4-yl]oxy}-4-hydroxy-5-methoxy-2-methyloxan-3-yl]oxy}-4,5-dihydroxy-3-{[(2S,3S,4R,5S,6S)-4-hydroxy-3,5-dimethoxy-6-methyloxan-2-yl]oxy}oxane-2-carboxylic acid
Citations