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Concept information

ترکیب اکسیژن ارگانیک > 6 هیدروکسیل پاسپالینین

Preferred term

6 هیدروکسیل پاسپالینین  

Type

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

charge

  • 0

formula

  • C27H31NO4

inchi

  • InChI=1S/C27H31NO4/c1-24(2)23-20(29)12-18-17-10-9-14-11-16-15-7-5-6-8-19(15)28-22(16)26(14,4)25(17,3)13-21(30)27(18,31-23)32-24/h5-8,12,14,17,21,23,28,30H,9-11,13H2,1-4H3/t14-,17-,21+,23-,25-,26+,27+/m0/s1

inchikey

  • SMUWWVMLCRYVKW-GOJHYGRYSA-N

mass

  • 433.548

monoisotopicmass

  • 433.22531

smiles

  • O=C1C=C2[C@@]3([C@H](O)C[C@]4([C@H]2CC[C@@H]5[C@@]4(C=6NC=7C=CC=CC7C6C5)C)C)O[C@@H]1C(O3)(C)C

subset

  • 2_STAR

synonym EXACT

  • (1R,2R,4S,5S,16S,19R,23R)-2-hydroxy-4,5,24,24-tetramethyl-25,26-dioxa-7-azaheptacyclo[21.2.1.01,20.04,19.05,16.06,14.08,13]hexacosa-6(14),8,10,12,20-pentaen-22-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:212603

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