skip to main content

Chemistry, part 2

Content language

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

Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > flavonoids > pterocarpans > (-)-maackiain-3-o-glucosyl-6''-o-malonate
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > benzofurochromene > pterocarpans > (-)-maackiain-3-o-glucosyl-6''-o-malonate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > benzofurochromene > pterocarpans > (-)-maackiain-3-o-glucosyl-6''-o-malonate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > benzofurochromene > pterocarpans > (-)-maackiain-3-o-glucosyl-6''-o-malonate

Preferred term

(-)-maackiain-3-o-glucosyl-6''-o-malonate  

Type

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

Broader concept

charge

  • 0

formula

  • C25H24O13

inchi

  • InChI=1S/C25H24O13/c26-19(27)6-20(28)33-8-18-21(29)22(30)23(31)25(38-18)36-10-1-2-11-14(3-10)32-7-13-12-4-16-17(35-9-34-16)5-15(12)37-24(11)13/h1-5,13,18,21-25,29-31H,6-9H2,(H,26,27)/t13-,18+,21+,22-,23+,24-,25+/m0/s1

inchikey

  • ZHXRWFOBROFZAC-LVYGOKBNSA-N

mass

  • 532.45030

monoisotopicmass

  • 532.12169

smiles

  • O[C@@H]1[C@@H](COC(=O)CC(O)=O)O[C@@H](Oc2ccc3[C@@H]4Oc5cc6OCOc6cc5[C@@H]4COc3c2)[C@H](O)[C@H]1O

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:80396

Download this concept:

RDF/XML TURTLE JSON-LD