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

Concept information

Preferred term

brocaenol c  

Type

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

Broader concept

charge

  • 0

formula

  • C16H12O8

inchi

  • InChI=1S/C16H12O8/c1-7-6-23-14(20)11-12(18)10-8(17)4-3-5-9(10)24-16(11,13(7)19)15(21)22-2/h3-6,17-18H,1-2H3/t16-/m0/s1

inchikey

  • BRCKHUUNFUINBT-INIZCTEOSA-N

mass

  • 332.264

monoisotopicmass

  • 332.05322

smiles

  • O=C1OC=C(C)C([C@@]2(C1=C(O)C3=C(C=CC=C3O)O2)C(=O)OC)=O

subset

  • 2_STAR

synonym EXACT

  • methyl (5aS)-10,11-dihydroxy-4-methyl-1,5-dioxooxepino[4,3-b]chromene-5a-carboxylate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:204596

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