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

Preferred term

pyrenosetin b  

Type

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

Broader concept

charge

  • 0

formula

  • C25H35NO5

inchi

  • InChI=1S/C25H35NO5/c1-13-6-8-17-16(10-13)11-14(2)20-18(9-7-15(3)28)25(22(30)24(17,20)4)21(29)19(12-27)26(5)23(25)31/h7,9,11,13,15-20,27-28H,6,8,10,12H2,1-5H3/t13-,15+,16+,17-,18+,19+,20+,24+,25-/m0/s1

inchikey

  • JBZGVPJZPTUTAU-OMXSNZPGSA-N

mass

  • 429.557

monoisotopicmass

  • 429.25152

smiles

  • O=C1N([C@H](CO)C([C@@]12C(=O)[C@@]3([C@@H]4[C@H](C[C@@H](C)CC4)C=C([C@@H]3[C@H]2C=C[C@H](O)C)C)C)=O)C

subset

  • 2_STAR

synonym EXACT

  • (2R,3R,3aS,5'R,5aR,7S,9aS,9bR)-3-[(3R)-3-hydroxybut-1-enyl]-5'-(hydroxymethyl)-1',4,7,9b-tetramethylspiro[3,3a,5a,6,7,8,9,9a-octahydrocyclopenta[a]naphthalene-2,3'-pyrrolidine]-1,2',4'-trione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:209658

Download this concept:

RDF/XML TURTLE JSON-LD