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Chemistry, part 2

Content language

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Concept information

... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > glycoside > 2-amino-4-(/{1-[(carboxymethyl)-c-hydroxycarbonimidoyl]-2-(/{2,3,6-trihydroxy-5-[(2e)-3-(4-hydroxyphenyl)prop-2-enoyl]-4-/{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy/}phenyl/}sulfanyl)ethyl/}-c-hydroxycarbonimidoyl)butanoic acid
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > flavonoids > 2-amino-4-(/{1-[(carboxymethyl)-c-hydroxycarbonimidoyl]-2-(/{2,3,6-trihydroxy-5-[(2e)-3-(4-hydroxyphenyl)prop-2-enoyl]-4-/{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy/}phenyl/}sulfanyl)ethyl/}-c-hydroxycarbonimidoyl)butanoic acid

Preferred term

2-amino-4-(/{1-[(carboxymethyl)-c-hydroxycarbonimidoyl]-2-(/{2,3,6-trihydroxy-5-[(2e)-3-(4-hydroxyphenyl)prop-2-enoyl]-4-/{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy/}phenyl/}sulfanyl)ethyl/}-c-hydroxycarbonimidoyl)butanoic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C31H37N3O17S

inchi

  • InChI=1S/C31H37N3O17S/c32-14(30(48)49)6-8-18(38)34-15(29(47)33-9-19(39)40)11-52-28-22(42)20(16(37)7-3-12-1-4-13(36)5-2-12)27(24(44)25(28)45)51-31-26(46)23(43)21(41)17(10-35)50-31/h1-5,7,14-15,17,21,23,26,31,35-36,41-46H,6,8-11,32H2,(H,33,47)(H,34,38)(H,39,40)(H,48,49)/b7-3+

inchikey

  • ICWJQDJRTZIBJX-XVNBXDOJSA-N

mass

  • 755.700

monoisotopicmass

  • 755.18437

smiles

  • S(C=1C(O)=C(C(OC2OC(C(O)C(O)C2O)CO)=C(O)C1O)C(=O)/C=C/C3=CC=C(O)C=C3)CC(NC(=O)CCC(N)C(O)=O)C(=O)NCC(O)=O

subset

  • 2_STAR

synonym EXACT

  • 2-amino-5-[[1-(carboxymethylamino)-1-oxo-3-[2,3,6-trihydroxy-5-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]sulanylpropan-2-yl]amino]-5-oxopentanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:185196

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