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 > sesterterpenoid > betaestacin va
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > sesterterpenoid > betaestacin va

Preferred term

betaestacin va  

Type

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

Broader concept

charge

  • 0

formula

  • C25H40O5

inchi

  • InChI=1S/C25H40O5/c1-15-6-7-19-18(16(2)22(27)28)8-11-23(19,3)14-21(26)25(5,30)13-10-20-17(15)9-12-24(20,4)29/h6,10,16-19,21,26,29-30H,7-9,11-14H2,1-5H3,(H,27,28)/b15-6-,20-10+/t16-,17-,18-,19+,21+,23-,24+,25+/m0/s1

inchikey

  • BKGYJGMVRKCUQI-AWROKZCASA-N

mass

  • 420.590

monoisotopicmass

  • 420.28757

smiles

  • O=C(O)[C@H]([C@H]1[C@@H]2[C@@](C[C@@H](O)[C@](O)(CC=C3[C@H](C(=CC2)C)CC[C@]3(O)C)C)(C)CC1)C

subset

  • 2_STAR

synonym EXACT

  • (2S)-2-[(1S,2Z,5R,6R,9S,11R,12R,14Z,16R)-11,12,16-trihydroxy-2,9,12,16-tetramethyl-6-tricyclo[13.3.0.05,9]octadeca-2,14-dienyl]propanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:217838

Download this concept:

RDF/XML TURTLE JSON-LD