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Concept information

Preferred term

bryophyllin a  

Type

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

Broader concept

charge

  • 0

formula

  • C26H32O8

has_functional_parent

inchi

  • InChI=1S/C26H32O8/c1-22-11-18(28)21-17(26(22,30)8-6-16(22)14-3-4-20(29)31-12-14)5-7-24-10-15-9-19(25(21,24)13-27)33-23(2,32-15)34-24/h3-4,12-13,15-19,21,28,30H,5-11H2,1-2H3/t15-,16+,17+,18+,19+,21+,22+,23?,24-,25+,26-/m0/s1

inchikey

  • BMRNQSAXDJQXEL-FGNGNWDISA-N

mass

  • 472.528

monoisotopicmass

  • 472.20972

smiles

  • C[C@]12C[C@@H](O)[C@H]3[C@@H](CC[C@@]45C[C@@H]6C[C@@H](OC(C)(O6)O4)[C@]35C=O)[C@@]1(O)CC[C@@H]2c1ccc(=O)oc1

subset

  • 2_STAR

synonym EXACT

  • Bryophyllin A

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:3199

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