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Concept information

Preferred term

Milbemycin K  

Type

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

Broader concept

charge

  • 0

formula

  • C32H44O7

inchi

  • InChI=1S/C32H44O7/c1-6-27-21(4)12-13-31(39-27)17-25-16-24(38-31)11-10-20(3)14-19(2)8-7-9-23-18-36-29-28(33)22(5)15-26(30(34)37-25)32(23,29)35/h7-10,15,19,21,24-27,29,35H,6,11-14,16-18H2,1-5H3/b8-7+,20-10+,23-9-/t19-,21-,24+,25-,26-,27+,29+,31+,32+/m0/s1

inchikey

  • UFQQXUKNLJUJRF-NGXPYQSGSA-N

mass

  • 540.697

monoisotopicmass

  • 540.30870

smiles

  • O=C1O[C@@H]2C[C@]3(O[C@@H](C2)CC=C(C[C@H](C=CC=C4[C@]5([C@H]1C=C(C(=O)[C@H]5OC4)C)O)C)C)O[C@@H]([C@@H](C)CC3)CC

subset

  • 2_STAR

synonym EXACT

  • (1R,4S,5'S,6R,6'R,8R,10E,13R,14E,16E,20S,24S)-6'-ethyl-24-hydroxy-5',11,13,22-tetramethylspiro[3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene-6,2'-oxane]-2,21-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:223049

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