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Chemistry, part 3

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > fe(iii)-[n-(c-5-[deoxy-beta-d-glucosyl]-2,3-dihydroxybenzoyl)-l-serine]2(2-)

Preferred term

fe(iii)-[n-(c-5-[deoxy-beta-d-glucosyl]-2,3-dihydroxybenzoyl)-l-serine]2(2-)  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • -2

formula

  • C32H35FeN2O21

inchi

  • InChI=1S/C32H40N2O21.Fe/c35-5-13(33-29(48)11-1-9(3-15(38)19(11)40)27-25(46)23(44)21(42)17(6-36)54-27)32(52)53-8-14(31(50)51)34-30(49)12-2-10(4-16(39)20(12)41)28-26(47)24(45)22(43)18(7-37)55-28;/h1-4,13-14,17-18,21-28,35-47H,5-8H2,(H,33,48)(H,34,49)(H,50,51);/q;+3/p-5/t13-,14-,17+,18+,21+,22+,23-,24-,25+,26+,27-,28-;/m0./s1

inchikey

  • GCFJENJKAKJHRU-YOSWHHHASA-I

mass

  • 839.471

monoisotopicmass

  • 839.10926

smiles

  • OC[C@H]1C(OC[C@@H](C([O-])=O)NC(=O)C2=C3C(=CC(=C2)[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O[Fe-]5(OC6=C(C=C(C=C6O5)[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)C(=O)N1)O3)=O

subset

  • 2_STAR

synonym RELATED

  • Fe(III)-[N-(C-5-[deoxy-beta-D-glucosyl]-2,3-dihydroxybenzoyl)-L-serine]2

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:143776

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