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 > organic hydroxy compound > alcohol > secondary alcohol > ent-cassa-12,15-dien-3beta-ol
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > alcohol > secondary alcohol > ent-cassa-12,15-dien-3beta-ol
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > isoprenoid > terpenoid > diterpenoid > ent-cassa-12,15-dien-3beta-ol
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > diterpenoid > ent-cassa-12,15-dien-3beta-ol

Preferred term

ent-cassa-12,15-dien-3beta-ol  

Type

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

Broader concept

charge

  • 0

formula

  • C20H32O

has_parent_hydride

inchi

  • InChI=1S/C20H32O/c1-6-14-7-9-16-15(13(14)2)8-10-17-19(3,4)18(21)11-12-20(16,17)5/h6-7,13,15-18,21H,1,8-12H2,2-5H3/t13-,15-,16-,17-,18-,20+/m1/s1

inchikey

  • BHRUCLDHUXEJQR-PHVPSJSMSA-N

mass

  • 288.46750

monoisotopicmass

  • 288.24532

smiles

  • [H][C@]12CC[C@]3([H])C(C)(C)[C@H](O)CC[C@@]3(C)[C@]1([H])CC=C(C=C)[C@H]2C

subset

  • 3_STAR

synonym EXACT

  • (2R,4aS,4bR,8S,8aR,10aS)-7-ethenyl-1,1,4a,8-tetramethyl-1,2,3,4,4a,4b,5,8,8a,9,10,10a-dodecahydrophenanthren-2-ol

synonym RELATED

  • (2R,4aS,4bR,8S,8aR,10aS)-1,1,4a,8-tetramethyl-7-vinyl-1,2,3,4,4a,4b,5,8,8a,9,10,10a-dodecahydrophenanthren-2-ol
  • 3alpha-hydroxy-ent-cassa-12,15-diene

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:72660

Download this concept:

RDF/XML TURTLE JSON-LD