CHEBI:88778 - Lacto-N-fucopentaose V

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Lacto-N-fucopentaose V
ChEBI ID CHEBI:88778
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C32H55NO25
Net Charge 0
Average Mass 853.772
Monoisotopic Mass 853.30632
InChI InChI=1S/C32H55NO25/c1-8-16(42)20(46)22(48)30(51-8)55-25(10(40)3-34)26(11(41)4-35)56-32-24(50)28(19(45)14(7-38)54-32)58-29-15(33-9(2)39)27(18(44)13(6-37)52-29)57-31-23(49)21(47)17(43)12(5-36)53-31/h3,8,10-32,35-38,40-50H,4-7H2,1-2H3,(H,33,39)/t8-,10-,11?,12+,13+,14+,15+,16?,17?,18+,19-,20?,21?,22-,23+,24+,25?,26+,27?,28-,29?,30-,31?,32-/m0/s1
InChIKey TVVLIFCVJJSLBL-SEHWTJTBSA-N
SMILES O([C@@H]1O[C@@H]([C@@H](O)[C@H](O[C@@H]2O[C@@H]([C@H](O)[C@H](O)[C@H]2O)CO)[C@H]1NC(=O)C)CO)[C@@H]3[C@@H](O)[C@@H](O[C@@H]([C@@H]3O)CO)O[C@@H]([C@H](O[C@@H]4O[C@H]([C@@H](O)[C@@H](O)[C@@H]4O)C)[C@@H](O)C=O)[C@H](O)CO
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in breast milk (ENVO:02000031). See: PubMed
ChEBI Ontology
Outgoing Lacto-N-fucopentaose V (CHEBI:88778) is a oligosaccharide (CHEBI:50699)
Synonyms Sources
LNFP V HMDB
N-[(3R,5S,6R)-2-{[(2R,3S,4S,5R,6S)-3,5-dihydroxy-2-(hydroxymethyl)-6-{[(3R,5R)-1,2,5-trihydroxy-6-oxo-4-{[(2S,3S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}hexan-3-yl]oxy}oxan-4-yl]oxy}-5-hydroxy-6-(hydroxymethyl)-4-{[(3R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-3-yl]acetamide HMDB
O-6-Deoxy-alpha-L-galactopyranosyl-(1->3)-O-[O-beta-D-galactopyranosyl-(1->3)-O-2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)]-D-Glucose HMDB
O-6-Deoxy-alpha-L-galactopyranosyl-(1->3)-O-[O-beta-delta-galactopyranosyl-(1->3)-O-2-(acetylamino)-2-deoxy-beta-delta-glucopyranosyl-(1->3)-beta-delta-galactopyranosyl-(1->4)]-delta-Glucose HMDB
Manual Xref Database
HMDB0006706 HMDB
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Registry Number Type Source
60254-64-0 CAS Registry Number KEGG COMPOUND
Citations Waiting for Citations Types Sources
11787692 PubMed citation Europe PMC
16954962 PubMed citation Europe PMC
17002410 PubMed citation Europe PMC
1802622 PubMed citation Europe PMC
3927775 PubMed citation Europe PMC
6638472 PubMed citation Europe PMC