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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 > organic hydroxy compound > repraesentin c
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > repraesentin c

Preferred term

repraesentin c  

Type

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

Broader concept

charge

  • 0

formula

  • C15H22O4

inchi

  • InChI=1S/C15H22O4/c1-13(12(18)19)4-8-5-15(3)10(16)7-14(2,11(15)17)9(8)6-13/h8-10,16H,4-7H2,1-3H3,(H,18,19)/t8-,9-,10+,13-,14-,15-/m0/s1

inchikey

  • LMJURNPIDVRJOJ-LWLBBTHZSA-N

mass

  • 266.337

monoisotopicmass

  • 266.15181

smiles

  • O=C1[C@@]2([C@H](O)C[C@]1([C@H]3C[C@](C(=O)O)(C)C[C@H]3C2)C)C

subset

  • 2_STAR

synonym EXACT

  • (1S,2S,4S,6R,8S,9R)-9-hydroxy-1,4,8-trimethyl-11-oxotricyclo[6.2.1.02,6]undecane-4-carboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:219039

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