CHEBI:91148 - HepMer_dp09_0001

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ChEBI Name HepMer_dp09_0001 ChEBI ID CHEBI:91148 Definition An amino nonasaccharide consisting of β-D-GlcA-(1→4)-α-D-GlcNS-(1→4)-β-D-GlcA-(1→4)-α-D-GlcNS-(1→4)-β-D-GlcA-(1→4)-α-D-GlcNS-(1→4)-β-D-GlcA-(1→4)-α-D-GlcNS(6S)-(1→4)-β-D-GlcA in which the hydrogen attached to the anomeric oxygen is replaced by a 4-nitrophenyl group. 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 C60H89N5O64S5 Net Charge 0 Average Mass 2064.677 Monoisotopic Mass 2063.24669 InChI InChI=1S/C60H89N5O64S5/c66-5-11-34(117-57-29(79)23(73)24(74)42(125-57)47(84)85)19(69)15(61-130(96,97)98)52(113-11)121-39-26(76)31(81)58(127-44(39)49(88)89)118-35-12(6-67)114-53(16(20(35)70)62-131(99,100)101)122-40-27(77)32(82)59(128-45(40)50(90)91)119-36-13(7-68)115-54(17(21(36)71)63-132(102,103)104)123-41-28(78)33(83)60(129-46(41)51(92)93)120-37-14(8-111-134(108,109)110)116-55(18(22(37)72)64-133(105,106)107)124-38-25(75)30(80)56(126-43(38)48(86)87)112-10-3-1-9(2-4-10)65(94)95/h1-4,11-46,52-64,66-83H,5-8H2,(H,84,85)(H,86,87)(H,88,89)(H,90,91)(H,92,93)(H,96,97,98)(H,99,100,101)(H,102,103,104)(H,105,106,107)(H,108,109,110)/t11-,12-,13-,14-,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+,41+,42+,43+,44+,45+,46+,52-,53-,54-,55-,56-,57-,58-,59-,60-/m1/s1 InChIKey GLAMRRAYUCMNEN-GHTJWXJUSA-N SMILES [C@H]1([C@H]([C@H](O)[C@H]([C@@H](O[C@H]2[C@H](O)[C@H]([C@@H](O[C@@H]2C(O)=O)OC=3C=CC(=CC3)[N+]([O-])=O)O)O1)NS(O)(=O)=O)O[C@@H]4O[C@H](C(O)=O)[C@H]([C@H](O)[C@H]4O)O[C@@H]5[C@@H]([C@@H](O)[C@@H]([C@H](O5)CO)O[C@@H]6O[C@H](C(O)=O)[C@H]([C@H](O)[C@H]6O)O[C@@H]7[C@@H]([C@@H](O)[C@@H]([C@H](O7)CO)O[C@@H]8O[C@H](C(O)=O)[C@H]([C@H](O)[C@H]8O)O[C@@H]9[C@@H]([C@@H](O)[C@@H]([C@H](O9)CO)O[C@@H]%10O[C@H](C(O)=O)[C@H]([C@H](O)[C@H]%10O)O)NS(O)(=O)=O)NS(O)(=O)=O)NS(O)(=O)=O)COS(O)(=O)=O ChEBI Ontology Outgoing HepMer_dp09_0001 (CHEBI:91148) is a C-nitro compound (CHEBI:35716) HepMer_dp09_0001 (CHEBI:91148) is a amino nonasaccharide (CHEBI:68818) HepMer_dp09_0001 (CHEBI:91148) is a carbohydrate acid derivative (CHEBI:63436) HepMer_dp09_0001 (CHEBI:91148) is a glycoside (CHEBI:24400) HepMer_dp09_0001 (CHEBI:91148) is a oligosaccharide sulfate (CHEBI:37909) IUPAC Name 4-nitrophenyl β-D-glucopyranuronosyl-(1→4)-2-deoxy-2-(sulfoamino)-α-D-glucopyranosyl-(1→4)-β-D-glucopyranuronosyl-(1→4)-2-deoxy-2-(sulfoamino)-α-D-glucopyranosyl-(1→4)-β-D-glucopyranuronosyl-(1→4)-2-deoxy-2-(sulfoamino)-α-D-glucopyranosyl-(1→4)-β-D-glucopyranuronosyl-(1→4)-2-deoxy-6-O-sulfo-2-(sulfoamino)-α-D-glucopyranosyl-(1→4)-β-D-glucopyranosiduronic acid Synonyms Sources β-D-GlcA-(1→4)-α-D-GlcNS-(1→4)-β-D-GlcA-(1→4)-α-D-GlcNS-(1→4)-β-D-GlcA-(1→4)-α-D-GlcNS-(1→4)-β-D-GlcA-(1→4)-α-D-GlcNS(6S)-(1→4)-β-D-GlcA-O-pNP ChEBI β-D-GlcpA-(1→4)-α-D-GlcpNS-(1→4)-β-D-GlcpA-(1→4)-α-D-GlcpNS-(1→4)-β-D-GlcpA-(1→4)-α-D-GlcpNS-(1→4)-β-D-GlcpA-(1→4)-α-D-GlcpNS(6S)-(1→4)-β-D-GlcpA-O-pNP ChEBI GlcUA-GlcNS-GlcUA-GlcNS-GlcUA-GlcNS-GlcUA-GlcNS(6S)-GlcUA-pNP ChEBI heparin nonasaccharide,N-sulfated, 6 sulfated ChEBI Citation Type Source 26575439 PubMed citation Europe PMC Last Modified 30 November 2017