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Chemistry, part 2

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > isoprenoid > terpenoid > triterpenoid > 3,20-dimethyl-1,2,21,22-tetradehydro-2,3,20,21-tetrahydrobotryococcene
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > triterpenoid > 3,20-dimethyl-1,2,21,22-tetradehydro-2,3,20,21-tetrahydrobotryococcene

Preferred term

3,20-dimethyl-1,2,21,22-tetradehydro-2,3,20,21-tetrahydrobotryococcene  

Type

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

Broader concept

charge

  • 0

formula

  • C32H54

has_functional_parent

has_role

inchi

  • InChI=1S/C32H54/c1-12-32(11,23-14-17-28(7)19-21-31(10)26(4)5)24-22-29(8)16-13-15-27(6)18-20-30(9)25(2)3/h12,15,17,22,24,29-31H,1-2,4,13-14,16,18-21,23H2,3,5-11H3/b24-22+,27-15+,28-17+/t29-,30?,31?,32-/m1/s1

inchikey

  • YIERDWVPDSIPLW-HDQHPOANSA-N

mass

  • 438.77120

monoisotopicmass

  • 438.42255

smiles

  • C[C@H](CC/C=C(/C)CCC(C)C(C)=C)/C=C/[C@@](C)(CC/C=C(/C)CCC(C)C(C)=C)C=C

subset

  • 3_STAR

synonym EXACT

  • 3,20-dimethyl-1,2,21,22-tetradehydro-2,3,20,21-tetrahydrobotryococcene
  • (6E,10S,11E,13R,16E)-10-ethenyl-2,3,6,10,13,17,20,21-octamethyl-docosa-1,6,11,16,21-pentaene

synonym RELATED

  • (6E,10S,11E,13R,16E)-2,3,6,10,13,17,20,21-octamethyl-10-vinyldocosa-1,6,11,16,21-pentaene
  • dimethylbotryococcene

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:70865

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