CHEBI:138679 - HP_dp06_0005

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ChEBI Name HP_dp06_0005 ChEBI ID CHEBI:138679 Definition A heparin hexasaccharide consisting of 4-deoxy-2-O-sulfo-α-L-threo-hex-4-enopyranuronosyl, 2-deoxy-6-O-sulfo-2-(sulfoamino)-α-D-glucopyranosyl, 2-O-sulfo-α-L-idopyranuronosyl, 2-acetamido-2-deoxy-α-D-glucopyranosyl, β-D-glucopyranuronosyl, and 2-deoxy-6-O-sulfo-2-(sulfoamino)-α-D-glucopyranose units joined in sequence by 1→4 linkages. Sequence: DUA2S-GlcNS6S-IdoA2S-GlcNAc-GlcA-GlcNS6S. Stars This entity has been manually annotated by the ChEBI Team. Submitter Sylvie RICARD-BLUM Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C38H59N3O49S6 Net Charge 0 Average Mass 1534.264 Monoisotopic Mass 1533.05414 InChI InChI=1S/C38H59N3O49S6/c1-6(43)39-13-16(46)22(9(3-42)80-34(13)85-25-18(48)19(49)36(87-28(25)31(53)54)82-23-10(4-76-93(64,65)66)78-33(57)12(15(23)45)40-91(58,59)60)83-38-27(90-96(73,74)75)20(50)26(29(88-38)32(55)56)86-35-14(41-92(61,62)63)17(47)24(11(81-35)5-77-94(67,68)69)84-37-21(89-95(70,71)72)7(44)2-8(79-37)30(51)52/h2,7,9-29,33-38,40-42,44-50,57H,3-5H2,1H3,(H,39,43)(H,51,52)(H,53,54)(H,55,56)(H,58,59,60)(H,61,62,63)(H,64,65,66)(H,67,68,69)(H,70,71,72)(H,73,74,75)/t7-,9+,10+,11+,12+,13+,14+,15+,16+,17+,18+,19+,20-,21+,22+,23+,24+,25-,26-,27+,28-,29+,33-,34+,35+,36+,37-,38+/m0/s1 InChIKey RCTLJCAJMSPXEP-DJRAQRCISA-N SMILES OS(N[C@H]1[C@H](O[C@@H]([C@H]([C@@H]1O)O[C@@H]2O[C@@H]([C@H]([C@@H]([C@H]2O)O)O[C@H]3O[C@@H]([C@H]([C@@H]([C@H]3NC(=O)C)O)O[C@@H]4O[C@H]([C@H]([C@@H]([C@H]4OS(O)(=O)=O)O)O[C@H]5O[C@@H]([C@H]([C@@H]([C@H]5NS(O)(=O)=O)O)O[C@@H]6OC(=C[C@@H]([C@H]6OS(O)(=O)=O)O)C(=O)O)COS(O)(=O)=O)C(=O)O)CO)C(=O)O)COS(O)(=O)=O)O)(=O)=O Metabolite of Species Details Sus scrofa (NCBI:txid9823) Porcine intestinal mucosa heparin See: PubMed ChEBI Ontology Outgoing HP_dp06_0005 (CHEBI:138679) is a amino hexasaccharide (CHEBI:61855) HP_dp06_0005 (CHEBI:138679) is a heparin hexasaccharide (CHEBI:139348) HP_dp06_0005 (CHEBI:138679) is a oligosaccharide sulfate (CHEBI:37909) IUPAC Name 4-deoxy-2-O-sulfo-α-L-threo-hex-4-enopyranuronosyl-(1→4)-2-deoxy-6-O-sulfo-2-(sulfoamino)-α-D-glucopyranosyl-(1→4)-2-O-sulfo-α-L-idopyranuronosyl-(1→4)-2-acetamido-2-deoxy-α-D-glucopyranosyl-(1→4)-β-D-glucopyranuronosyl-(1→4)-2-deoxy-6-O-sulfo-2-(sulfoamino)-α-D-glucopyranose Synonym Source alpha-delta4,5-UA(2S)-(1-4)-alpha-D-GlcpNS(6S)-(1-4)-alpha-L-IdopA(2S)-(1-4)-alpha-D-GlcpNAc-(1-4)-beta-D-GlcpA-(1-4)-alpha-D-GlcpNS(6S) IUPAC Manual Xref Database G40967YY GlyTouCan View more database links Citation Type Source 20729345 PubMed citation Europe PMC Last Modified 22 January 2018