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Chemistry, part 3

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 > aspergiltriene a

Preferred term

aspergiltriene a  

Type

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

Broader concept

charge

  • 0

formula

  • C25H40

inchi

  • InChI=1S/C25H40/c1-17(2)21-14-16-25(6)15-13-18(3)7-10-22-19(4)8-11-23(22)20(5)9-12-24(21)25/h9,13,17,21,23-24H,7-8,10-12,14-16H2,1-6H3/b18-13+,20-9+/t21-,23-,24-,25-/m0/s1

inchikey

  • XKIZMGBGGHNTGM-ACCKHRCUSA-N

mass

  • 340.595

monoisotopicmass

  • 340.31300

smiles

  • C1CC(=CC[C@@]2([C@@](CC=C([C@]3(C1=C(CC3)C)[H])C)([C@@H](CC2)C(C)C)[H])C)C

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:189071

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