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Concept information

Preferred term

lythrancine iv  

Type

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

Broader concept

charge

  • 0

formula

  • C33H41NO8

inchi

  • InChI=1S/C33H41NO8/c1-19(35)40-25-12-9-22-10-13-30(38-4)26(15-22)27-16-23(11-14-31(27)39-5)29-18-32(41-20(2)36)33(42-21(3)37)28-8-6-7-24(17-25)34(28)29/h10-11,13-16,24-25,28-29,32-33H,6-9,12,17-18H2,1-5H3/t24-,25+,28?,29+,32+,33-/m0/s1

inchikey

  • NEKIHSCHYFCIRU-PPYIFFAJSA-N

mass

  • 579.690

monoisotopicmass

  • 579.28322

smiles

  • O([C@H]1C2N3[C@@](CCC2)(C[C@H](OC(=O)C)CCC4=CC(C=5C=C([C@]3(C[C@H]1OC(=O)C)[H])C=CC5OC)=C(OC)C=C4)[H])C(=O)C

subset

  • 2_STAR

synonym EXACT

  • [(1R,14R,16S,21S,22R)-21,22-diacetyloxy-5,8-dimethoxy-24-azapentacyclo[14.7.1.12,6.17,11.020,24]hexacosa-2(26),3,5,7,9,11(25)-hexaen-14-yl] acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:229158

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