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Concept information

Preferred term

گانودرملاکتون U  

Type

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

Broader concept

charge

  • 0

formula

  • C32H48O8

inchi

  • InChI=1S/C32H48O8/c1-18-16-24(34)27(40-28(18)37)19(2)21-10-13-31(7)22-8-9-25(29(4,5)38)32(15-12-26(35)36,17-39-20(3)33)23(22)11-14-30(21,31)6/h16,19,21,24-25,27,34,38H,8-15,17H2,1-7H3,(H,35,36)/t19-,21+,24-,25-,27+,30+,31-,32-/m0/s1

inchikey

  • JEUFRKRLACMISC-WJGWNSPVSA-N

mass

  • 560.728

monoisotopicmass

  • 560.33492

smiles

  • O=C1O[C@@H]([C@@H](O)C=C1C)[C@H]([C@@H]2[C@@]3([C@@](C4=C([C@@]([C@H](C(O)(C)C)CC4)(COC(=O)C)CCC(=O)O)CC3)(C)CC2)C)C

subset

  • 2_STAR

synonym EXACT

  • 3-[(3R,3aR,6R,7R,9bR)-6-(acetyloxymethyl)-3-[(1S)-1-[(2R,3S)-3-hydroxy-5-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-7-(2-hydroxypropan-2-yl)-3a,9b-dimethyl-1,2,3,4,5,7,8,9-octahydrocyclopenta[a]naphthalen-6-yl]propanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:226716

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