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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 > sesterterpenoid > betaestacin iii
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > sesterterpenoid > betaestacin iii

Preferred term

betaestacin iii  

Type

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

Broader concept

charge

  • 0

formula

  • C25H40O

inchi

  • InChI=1S/C25H40O/c1-17-6-9-21-18(2)7-10-22(21)19(3)8-11-24-23(20(4)16-26)13-15-25(24,5)14-12-17/h8-9,12,18,20,22-24,26H,6-7,10-11,13-16H2,1-5H3/b17-12+,19-8-,21-9-/t18-,20+,22-,23-,24+,25+/m0/s1

inchikey

  • RTSBHYOVQSBPLR-MQQCBZHFSA-N

mass

  • 356.594

monoisotopicmass

  • 356.30792

smiles

  • OC[C@H]([C@H]1[C@@H]2[C@@](CC=C(CC=C3[C@H](C(=CC2)C)CC[C@@H]3C)C)(C)CC1)C

subset

  • 2_STAR

synonym EXACT

  • (2S)-2-[(1S,2Z,5R,6R,9S,11E,14E,16S)-2,9,12,16-tetramethyl-6-tricyclo[13.3.0.05,9]octadeca-2,11,14-trienyl]propan-1-ol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:217826

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