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Chemistry, part 2

Content language

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Concept information

organooxygen compound > ester > diester > bis(beta-d-glucosyl) crocetin
... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > glycoside > hexoside > glucoside > d-glucoside > beta-d-glucoside > bis(beta-d-glucosyl) crocetin

Preferred term

bis(beta-d-glucosyl) crocetin  

Type

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

Broader concept

charge

  • 0

formula

  • C32H44O14

has_functional_parent

inchi

  • InChI=1S/C32H44O14/c1-17(11-7-13-19(3)29(41)45-31-27(39)25(37)23(35)21(15-33)43-31)9-5-6-10-18(2)12-8-14-20(4)30(42)46-32-28(40)26(38)24(36)22(16-34)44-32/h5-14,21-28,31-40H,15-16H2,1-4H3/b6-5+,11-7+,12-8+,17-9+,18-10+,19-13+,20-14+/t21-,22-,23-,24-,25+,26+,27-,28-,31+,32+/m1/s1

inchikey

  • QBZWPZHDUZGTLS-IIDMIUPYSA-N

mass

  • 652.68340

monoisotopicmass

  • 652.27311

smiles

  • CC(/C=C/C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=C/C=C/C=C(C)/C=C/C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

subset

  • 3_STAR

synonym EXACT

  • bis[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl] (2E,4E,6E,8E,10E,12E,14E)-2,6,11,15-tetramethylhexadeca-2,4,6,8,10,12,14-heptaenedioate
  • bis(beta-D-glucosyl) crocetin

synonym RELATED

  • all-trans-crocetin di(beta-D-glucosyl) ester
  • crocetin di(beta-D-glucopyranosyl) ester
  • dicrocin
  • trans-crocetin di(beta-D-glucosyl) ester

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:62768

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