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Concept information

Preferred term

pc-m5'  

Type

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

charge

  • 0

formula

  • C29H37NO5

inchi

  • InChI=1S/C29H37NO5/c1-16(31)34-23-15-20-22(35-25(23)26(2,3)32)11-12-27(4)28(5)17(10-13-29(20,27)33)14-19-18-8-6-7-9-21(18)30-24(19)28/h6-9,15,17,22-23,25,30,32-33H,10-14H2,1-5H3/t17-,22-,23+,25-,27+,28+,29+/m0/s1

inchikey

  • IMABPJDBODVJSN-HKZMUHMQSA-N

mass

  • 479.617

monoisotopicmass

  • 479.26717

smiles

  • O[C@]12[C@@]([C@@]3([C@@](CC1)(CC4=C3NC=5C4=CC=CC5)[H])C)(CC[C@@]6(O[C@@]([C@H](OC(=O)C)C=C26)(C(O)(C)C)[H])[H])C

subset

  • 2_STAR

synonym EXACT

  • [(1S,2R,5S,7S,8R,11S,14S)-11-hydroxy-7-(2-hydroxypropan-2-yl)-1,2-dimethyl-6-oxa-23-azahexacyclo[12.10.0.02,11.05,10.016,24.017,22]tetracosa-9,16(24),17,19,21-pentaen-8-yl] acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:176165

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