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Contact us: CRM@email.irandoc.ac.ir

Concept information

Preferred term

chlorajaposide, (rel)-  

Type

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

Broader concept

charge

  • 0

formula

  • C21H28O8

has_role

inchi

  • InChI=1S/C21H28O8/c1-8-10-4-13(10)20(3)7-21(12(5-11(8)20)9(2)18(26)28-21)29-19-17(25)16(24)15(23)14(6-22)27-19/h10-11,13-17,19,22-25H,1,4-7H2,2-3H3/t10-,11+,13-,14-,15-,16+,17-,19+,20-,21-/m1/s1

inchikey

  • DIHJSNVGGKCCRW-IFIACUTQSA-N

mass

  • 408.44220

monoisotopicmass

  • 408.17842

smiles

  • [H][C@]1(O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)O[C@]12C[C@]3(C)[C@@]([H])(CC1=C(C)C(=O)O2)C(=C)[C@@]1([H])C[C@@]31[H]

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:70176

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