CHEBI:59381 - GPL-25

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ChEBI Name GPL-25
ChEBI ID CHEBI:59381
Definition A glycopeptidolipid antigen from clinically prominent members of the Mycobacterium avium serocomplex.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C93H161N5O33
Net Charge 0
Average Mass 1877.28710
Monoisotopic Mass 1876.10738
InChI InChI=1S/C93H161N5O33/c1-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-39-40-44-47-61(100)49-63(101)97-62(48-60-45-42-41-43-46-60)85(112)98-65(86(113)95-52(3)84(111)94-51(2)50-120-88-74(110)78(117-12)76(116-11)58(9)125-88)54(5)122-93-82(69(105)66(102)55(6)124-93)130-90-73(109)77(67(103)56(7)123-90)128-92-81(119-14)72(108)75(57(8)126-92)127-89-71(107)70(106)79(83(131-89)87(114)115)129-91-80(118-13)68(104)64(53(4)121-91)96-59(10)99/h41-43,45-46,51-58,61-62,64-83,88-93,100,102-110H,15-40,44,47-50H2,1-14H3,(H,94,111)(H,95,113)(H,96,99)(H,97,101)(H,98,112)(H,114,115)/t51-,52+,53-,54+,55-,56-,57-,58-,61?,62+,64+,65+,66+,67-,68+,69+,70+,71+,72+,73+,74+,75+,76-,77+,78-,79-,80-,81-,82+,83-,88?,89+,90-,91-,92-,93?/m0/s1
InChIKey ITEFOUARIRZXCU-JZPCVTHUSA-N
SMILES CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H]([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@@H](O[C@@H]4O[C@@H](C)[C@@H](NC(C)=O)[C@@H](O)[C@@H]4OC)[C@H](O)[C@H]3O)C(O)=O)[C@@H](O)[C@@H]2OC)[C@H]1O)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
Metabolite of Species Details
Mycobacterium avium (NCBI:txid1764) See: PubMed
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Biological Role(s): 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).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing GPL-25 (CHEBI:59381) has role antigen (CHEBI:59132)
GPL-25 (CHEBI:59381) is a glycopeptidolipid (CHEBI:59375)
IUPAC Name
(2S,3S,4R,5R,6R)-3-{[(2S,3S,4R,5S,6S)-5-acetamido-4-hydroxy-3-methoxy-6-methyloxan-2-yl]oxy}-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-dihydroxyoxane-2-carboxylic acid
Citation Waiting for Citations Type Source
1284113 PubMed citation Europe PMC
Last Modified
15 December 2016