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Contact us: CRM@email.irandoc.ac.ir

Concept information

Preferred term

icas#7 (1)  

Type

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

charge

  • -1

formula

  • C22H26NO7

inchi

  • InChI=1S/C22H27NO7/c1-13(7-3-6-10-20(25)26)28-22-18(24)11-19(14(2)29-22)30-21(27)16-12-23-17-9-5-4-8-15(16)17/h4-6,8-10,12-14,18-19,22-24H,3,7,11H2,1-2H3,(H,25,26)/p-1/b10-6+/t13-,14+,18-,19-,22-/m1/s1

inchikey

  • OVHQEHRYORHTRQ-KXXILVSQSA-M

mass

  • 416.445

monoisotopicmass

  • 416.17148

smiles

  • C[C@H](CC/C=C/C([O-])=O)O[C@@H]1O[C@@H](C)[C@@H](C[C@H]1O)OC(=O)C2=CNC3=CC=CC=C23

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:140803

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