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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 > 3-o-acetyl-8-o-demethylmaritidine trifluoroacetic acid

Preferred term

3-o-acetyl-8-o-demethylmaritidine trifluoroacetic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C20H22F3NO6

has_role

inchi

  • InChI=1S/C18H21NO4.C2HF3O2/c1-11(20)23-13-3-4-18-5-6-19(17(18)8-13)10-12-7-15(21)16(22-2)9-14(12)18;3-2(4,5)1(6)7/h3-4,7,9,13,17,21H,5-6,8,10H2,1-2H3;(H,6,7)/t13-,17+,18+;/m1./s1

inchikey

  • HERFZNMLZYGZDD-CHPYXAQWSA-N

mass

  • 429.38700

monoisotopicmass

  • 429.13992

smiles

  • OC(=O)C(F)(F)F.[H][C@]12C[C@H](OC(C)=O)C=C[C@@]11CCN2Cc2cc(O)c(OC)cc12

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:68315

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