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

Concept information

Preferred term

athrolide b  

Type

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

Broader concept

charge

  • 0

formula

  • C21H30O7

has_role

inchi

  • InChI=1S/C21H30O7/c1-9(2)19(24)28-14-8-15(26-12(5)22)21(6)17(14)10(3)7-13-16(18(21)23)11(4)20(25)27-13/h9-10,13-18,23H,4,7-8H2,1-3,5-6H3/t10-,13+,14+,15-,16-,17-,18-,21-/m1/s1

inchikey

  • BHEXSLGHYNIAGL-WDCRBBJTSA-N

mass

  • 394.45870

monoisotopicmass

  • 394.19915

smiles

  • [H][C@]12C[C@@H](C)[C@]3([H])[C@H](C[C@@H](OC(C)=O)[C@@]3(C)[C@H](O)[C@]1([H])C(=C)C(=O)O2)OC(=O)C(C)C

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:69659

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