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 > secondary alpha-hydroxy ketone > penicilliumin b
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > alcohol > secondary alcohol > secondary alpha-hydroxy ketone > penicilliumin b
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic hydroxy compound > alpha-hydroxy ketone > secondary alpha-hydroxy ketone > penicilliumin b
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > alpha-hydroxy ketone > secondary alpha-hydroxy ketone > penicilliumin b
... > organooxygen compound > carbonyl compound > ketone > alpha-hydroxy ketone > secondary alpha-hydroxy ketone > penicilliumin b
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > ketone > alpha-hydroxy ketone > secondary alpha-hydroxy ketone > penicilliumin b
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > alpha-hydroxy ketone > secondary alpha-hydroxy ketone > penicilliumin b

Preferred term

penicilliumin b  

Type

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

Broader concept

charge

  • 0

formula

  • C21H30O3

inchi

  • InChI=1S/C21H30O3/c1-13-7-8-16-19(3,4)9-6-10-20(16,5)15(13)12-21(24)17(22)11-14(2)18(21)23/h11,15-16,24H,1,6-10,12H2,2-5H3/t15-,16-,20+,21-/m0/s1

inchikey

  • IIOSVAZNNYCZFM-AFMUBRCDSA-N

mass

  • 330.468

monoisotopicmass

  • 330.21949

smiles

  • O=C1C(=CC([C@@]1(O)C[C@H]2C(=C)CC[C@@H]3[C@@]2(CCCC3(C)C)C)=O)C

subset

  • 2_STAR

synonym EXACT

  • (2S)-2-[[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]methyl]-2-hydroxy-4-methylcyclopent-4-ene-1,3-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:206929

Download this concept:

RDF/XML TURTLE JSON-LD