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 > medicarpin 3-o-glucoside-6'-malonate
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > benzofurochromene > pterocarpans > medicarpin 3-o-glucoside-6'-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 > medicarpin 3-o-glucoside-6'-malonate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > benzofurochromene > pterocarpans > medicarpin 3-o-glucoside-6'-malonate

Preferred term

medicarpin 3-o-glucoside-6'-malonate  

Type

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

Broader concept

charge

  • 0

formula

  • C25H26O12

inchi

  • InChI=1S/C25H26O12/c1-32-11-2-4-13-15-9-33-16-7-12(3-5-14(16)24(15)36-17(13)6-11)35-25-23(31)22(30)21(29)18(37-25)10-34-20(28)8-19(26)27/h2-7,15,18,21-25,29-31H,8-10H2,1H3,(H,26,27)/t15-,18+,21+,22-,23+,24-,25+/m0/s1

inchikey

  • BQAJKXKYTQTBDK-PCHDOLKHSA-N

mass

  • 518.46670

monoisotopicmass

  • 518.14243

smiles

  • COc1ccc2[C@@H]3COc4cc(O[C@@H]5O[C@H](COC(=O)CC(O)=O)[C@@H](O)[C@H](O)[C@H]5O)ccc4[C@@H]3Oc2c1

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:80391

Download this concept:

RDF/XML TURTLE JSON-LD