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CHEBI:88778 - Lacto-N-fucopentaose V

ChEBI IDCHEBI:88778
ChEBI NameLacto-N-fucopentaose V
Stars
DownloadsMolfile
FormulaC32H55NO25
Net Charge0
Average Mass853.774
Monoisotopic Mass853.30632
SMILESCC(=O)N[C@H]1C(O[C@H]2[C@@H](O)[C@@H](CO)O[C@@H](O[C@H](C(O)CO)C(O[C@@H]3O[C@@H](C)C(O)C(O)[C@@H]3O)[C@@H](O)C=O)[C@@H]2O)O[C@H](CO)[C@@H](O)C1OC1O[C@H](CO)C(O)C(O)[C@H]1O
WURCSWURCS=2.0/4,5,4/[o212xh][a1221m-1a_1-5][a2112h-1b_1-5][a2122h-1b_1-5_2*NCC/3=O]/1-2-3-4-3/a3-b1_a4-c1_c3-d1_d3-e1
InChIInChI=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
InChIKeyTVVLIFCVJJSLBL-SEHWTJTBSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) breast milk (ENVO:02000031) PubMed (11787692)
ChEBI Ontology
Outgoing Relation(s)
Lacto-N-fucopentaose V (CHEBI:88778) is a oligosaccharide (CHEBI:50699)
Synonyms  Source
LNFP VHMDB
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-GlucoseHMDB
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]acetamideHMDB
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-GlucoseHMDB
Manual XrefsDatabases
HMDB0006706HMDB
Registry NumbersSources
CAS:60254-64-0KEGG COMPOUND
Citations