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Concept information

Preferred term

راوکافریسین  

Type

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

alt_id

  • CHEBI:15016
  • CHEBI:26522
  • CHEBI:8780

charge

  • 0

formula

  • C27H32N2O8

has_functional_parent

inchi

  • InChI=1S/C27H32N2O8/c1-3-12-13-8-16-23-27(14-6-4-5-7-15(14)28-23)9-17(19(13)24(27)35-11(2)31)29(16)25(12)37-26-22(34)21(33)20(32)18(10-30)36-26/h3-7,13,16-22,24-26,30,32-34H,8-10H2,1-2H3/b12-3+/t13-,16-,17-,18+,19?,20+,21-,22+,24+,25+,26-,27+/m0/s1

inchikey

  • OSJPGOJPRNTSHP-ICYIRATMSA-N

mass

  • 512.55166

monoisotopicmass

  • 512.21587

smiles

  • [H][C@@]12C[C@]3([H])N([C@H]4C[C@@]5([C@H](OC(C)=O)C14)c1ccccc1N=C35)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)/C2=C/C

subset

  • 3_STAR

synonym EXACT

  • (16S,17R,19E)-21alpha-(beta-D-glucopyranosyloxy)-1,2-didehydro-2,7-dihydro-7beta,17-cyclosarpagan-17-yl acetate
  • Raucaffricine
  • raucaffricine

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:17400

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