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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 > n(1)-(3,4-dihydroxybenzoyl)-n(8)-citryl-spermidine (1-)

Preferred term

n(1)-(3,4-dihydroxybenzoyl)-n(8)-citryl-spermidine (1-)  

Type

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

Broader concept

charge

  • -1

formula

  • C20H28N3O9

inchi

  • InChI=1S/C20H29N3O9/c24-14-5-4-13(10-15(14)25)18(29)23-9-3-7-21-6-1-2-8-22-16(26)11-20(32,19(30)31)12-17(27)28/h4-5,10,21,24-25,32H,1-3,6-9,11-12H2,(H,22,26)(H,23,29)(H,27,28)(H,30,31)/p-1

inchikey

  • FXIUYHSBLDKCJD-UHFFFAOYSA-M

mass

  • 454.457

monoisotopicmass

  • 454.18310

smiles

  • C(=O)([O-])C(CC(=O)NCCCC[NH2+]CCCNC(C1=CC=C(C(=C1)O)O)=O)(CC(=O)[O-])O

subset

  • 2_STAR

synonym RELATED

  • N(1)-(3,4-dihydroxybenzoyl)-N(8)-citryl-spermidine

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:149593

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