skip to main content

Chemistry, part 1

Content language

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

Concept information

... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > carbohydrate acid derivative > glucosiduronic acid > (2r,3r,4r,5s)-6-[4-(3-/{[2-(3-carbamoyl-4-hydroxyphenyl)-2-hydroxyethyl]amino/}butyl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > glycoside > glycosiduronic acid > glucosiduronic acid > (2r,3r,4r,5s)-6-[4-(3-/{[2-(3-carbamoyl-4-hydroxyphenyl)-2-hydroxyethyl]amino/}butyl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

Preferred term

(2r,3r,4r,5s)-6-[4-(3-/{[2-(3-carbamoyl-4-hydroxyphenyl)-2-hydroxyethyl]amino/}butyl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C25H32N2O10

inchi

  • InChI=1S/C25H32N2O10/c1-12(27-11-18(29)14-6-9-17(28)16(10-14)23(26)33)2-3-13-4-7-15(8-5-13)36-25-21(32)19(30)20(31)22(37-25)24(34)35/h4-10,12,18-22,25,27-32H,2-3,11H2,1H3,(H2,26,33)(H,34,35)/t12?,18?,19-,20-,21+,22-,25?/m0/s1

inchikey

  • KCEJCVJALDWNQV-DAFDMZOXSA-N

mass

  • 520.530

monoisotopicmass

  • 520.206

smiles

  • O=C(N)C1=C(O)C=CC(=C1)C(O)CNC(CCC2=CC=C(OC3O[C@H](C(=O)O)[C@@H](O)[C@@H]([C@H]3O)O)C=C2)C

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:143442

Download this concept:

RDF/XML TURTLE JSON-LD