skip to main content

Chemistry, part 2

Content language

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

Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > phenylpropanoid > cardinalin 8
... > 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 aromatic compound > phenylpropanoid > cardinalin 8
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > phenylpropanoid > cardinalin 8

Preferred term

cardinalin 8  

Type

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

Broader concept

charge

  • 0

formula

  • C32H38O10

inchi

  • InChI=1S/C32H38O10/c1-11-7-15-21(13(3)41-11)29(35)23-17(27(15)33)9-19(39-5)25(31(23)37)26-20(40-6)10-18-24(32(26)38)30(36)22-14(4)42-12(2)8-16(22)28(18)34/h9-16,21-22,27-28,33-34,37-38H,7-8H2,1-6H3/t11-,12-,13+,14+,15+,16+,21+,22+,27+,28+/m0/s1

inchikey

  • AIUGWOVGEYHKII-VBBUSCQISA-N

mass

  • 582.646

monoisotopicmass

  • 582.24650

smiles

  • O=C1C2=C(O)C(C3=C(O)C=4C(=O)[C@H]5[C@@H](C[C@H](C)O[C@@H]5C)[C@H](C4C=C3OC)O)=C(OC)C=C2[C@H](O)[C@H]6[C@H]1[C@H](O[C@H](C6)C)C

subset

  • 2_STAR

synonym EXACT

  • (1R,3S,4aR,5R,10aS)-8-[(1R,3S,4aR,5R,10aS)-5,9-dihydroxy-7-methoxy-1,3-dimethyl-10-oxo-1,3,4,4a,5,10a-hexahydrobenzo[g]isochromen-8-yl]-5,9-dihydroxy-7-methoxy-1,3-dimethyl-1,3,4,4a,5,10a-hexahydrobenzo[g]isochromen-10-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:197555

Download this concept:

RDF/XML TURTLE JSON-LD