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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 > monoterpenoid > iridoid monoterpenoid > magnicol e
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > monoterpenoid > iridoid monoterpenoid > magnicol e

Preferred term

magnicol e  

Type

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

Broader concept

charge

  • 0

formula

  • C25H40O4

inchi

  • InChI=1S/C25H40O4/c1-15-8-9-25-16(2)6-7-17(25)20-22(3,12-18(15)25)10-11-23(20,4)13-19(27)21(28)24(5,29)14-26/h12,15-17,19-20,26-27,29H,6-11,13-14H2,1-5H3/t15-,16-,17-,19-,20-,22+,23+,24?,25-/m0/s1

inchikey

  • WCMVXSJCZKPSHR-SOHPHPDSSA-N

mass

  • 404.591

monoisotopicmass

  • 404.29266

smiles

  • O=C(C(O)(CO)C)[C@@H](O)C[C@@]1([C@@H]2[C@](C=C3[C@@H](C)CC[C@@]43[C@H]2CC[C@@H]4C)(C)CC1)C

subset

  • 2_STAR

synonym EXACT

  • (4S)-1,2,4-trihydroxy-2-methyl-5-[(1S,2S,5S,6R,7R,10R,13S)-2,7,10,13-tetramethyl-7-tetracyclo[10.3.0.01,5.06,10]pentadec-11-enyl]pentan-3-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:197778

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