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Concept information

Preferred term

tyromycic acid d  

Type

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

Broader concept

charge

  • 0

formula

  • C30H44O4

inchi

  • InChI=1S/C30H44O4/c1-18(9-8-10-19(2)26(33)34)20-13-16-29(6)21-11-12-23-27(3,4)24(31)14-15-28(23,5)22(21)17-25(32)30(20,29)7/h10-11,17-18,20,23,25,32H,8-9,12-16H2,1-7H3,(H,33,34)/b19-10-/t18-,20-,23+,25-,28-,29+,30+/m1/s1

inchikey

  • MUYQNDWZUCOTJV-RMYJVROOSA-N

mass

  • 468.678

monoisotopicmass

  • 468.32396

smiles

  • O=C1C([C@H]2[C@](C=3C([C@]4([C@]([C@@H]([C@@H](CC/C=C(/C(=O)O)/C)C)CC4)(C)[C@@H](C3)O)C)=CC2)(C)CC1)(C)C

subset

  • 2_STAR

synonym EXACT

  • (Z,6R)-6-[(5R,10S,12R,13R,14S,17R)-12-hydroxy-4,4,10,13,14-pentamethyl-3-oxo-1,2,5,6,12,15,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-2-methylhept-2-enoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:227145

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