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 > isoprenoid > terpenoid > diterpenoid > inonotusic acid
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > diterpenoid > inonotusic acid

Preferred term

inonotusic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C21H28O2

inchi

  • InChI=1S/C21H28O2/c1-13(2)15-7-8-17-16(11-15)18(23)12-19-20(4,5)9-6-10-21(17,19)14(3)22/h7-8,11,13,19H,6,9-10,12H2,1-5H3/t19-,21-/m0/s1

inchikey

  • RTVFQOBGBPANTH-FPOVZHCZSA-N

mass

  • 312.453

monoisotopicmass

  • 312.20893

smiles

  • O=C1C2=C(C=CC(=C2)C(C)C)[C@@]3(C(=O)C)CCCC([C@@H]3C1)(C)C

subset

  • 2_STAR

synonym EXACT

  • (4aR,10aS)-4a-acetyl-1,1-dimethyl-7-propan-2-yl-3,4,10,10a-tetrahydro-2H-phenanthren-9-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:214668

Download this concept:

RDF/XML TURTLE JSON-LD