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Chemistry, part 2

Content language

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Concept information

organooxygen compound > oxacycle > pyrans > pyranone > tomophagusin d
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > pyrans > pyranone > tomophagusin d
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > pyrans > pyranone > tomophagusin d
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > pyrans > pyranone > tomophagusin d
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteromonocyclic compound > pyrans > pyranone > tomophagusin d
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteromonocyclic compound > pyrans > pyranone > tomophagusin d
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteromonocyclic compound > pyrans > pyranone > tomophagusin d

Preferred term

tomophagusin d  

Type

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

Broader concept

charge

  • 0

formula

  • C28H38O5

inchi

  • InChI=1S/C28H38O5/c1-17-5-8-23(33-25(17)31)18(2)20-9-12-27(4)21-7-6-19-15-32-16-28(19,14-11-24(29)30)22(21)10-13-26(20,27)3/h5,7,10,18-20,23H,6,8-9,11-16H2,1-4H3,(H,29,30)/t18-,19-,20+,23-,26+,27-,28+/m0/s1

inchikey

  • BTNCFAHIQWSSRN-SDPFRIKESA-N

mass

  • 454.607

monoisotopicmass

  • 454.27192

smiles

  • O=C1O[C@H]([C@H]([C@@H]2[C@@]3([C@@](C=4C([C@]5([C@H](COC5)CC4)CCC(=O)O)=CC3)(C)CC2)C)C)CC=C1C

subset

  • 2_STAR

synonym EXACT

  • 3-[(3aR,5aR,6R,8aR,10aR)-5a,8a-dimethyl-6-[(1S)-1-[(2S)-5-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-1,3,5,6,7,8,10,10a-octahydroindeno[5,4-e][2]benzouran-3a-yl]propanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:223620

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