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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 > japonicumins a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > triterpenoid > japonicumins a

Preferred term

japonicumins a  

Type

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

Broader concept

charge

  • 0

formula

  • C31H50O3

inchi

  • InChI=1S/C31H50O3/c1-19-15-20-17-28(4)13-9-22-29(5,18-32)11-8-12-30(22,6)23(28)16-21(33)25(20)31(7)14-10-24(34)27(2,3)26(19)31/h15,21-26,32-34H,1,8-14,16-18H2,2-7H3/t21-,22?,23?,24-,25-,26+,28+,29-,30+,31-/m1/s1

inchikey

  • IBNJDPMGYWBTDV-IOSCOXFYSA-N

mass

  • 470.738

monoisotopicmass

  • 470.37600

smiles

  • O[C@H]1[C@@]2([C@@]3([C@](C([C@H](O)CC3)(C)C)(C(C=C2C[C@]4(C([C@@]5(C([C@](CCC5)(CO)C)CC4)C)C1)C)=C)[H])C)[H]

subset

  • 2_STAR

synonym EXACT

  • (1S,6R,8R,11S,12S,13R,16R,20S)-20-(hydroxymethyl)-1,7,7,11,16,20-hexamethyl-5-methylidenepentacyclo[13.8.0.03,12.06,11.016,21]tricos-3-ene-8,13-diol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:188022

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