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Concept information

Preferred term

لونگیروستررون B  

Type

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

alt_id

  • CHEBI:68772

charge

  • 0

formula

  • C31H42O6

inchi

  • InChI=1S/C31H42O6/c1-7-18(2)10-20(4)11-19(3)8-9-23(32)15-26-25-17-37-28(13-22(25)14-29(35)31(26,6)36)30-21(5)12-24(33)16-27(30)34/h8-9,11,13-14,17-18,20-21,24,26,30,33,36H,7,10,12,15-16H2,1-6H3/b9-8+,19-11+/t18?,20?,21-,24+,26-,30+,31+/m0/s1

inchikey

  • PZWVXQVKPAZYRZ-GIIUFEGQSA-N

mass

  • 510.66160

monoisotopicmass

  • 510.29814

smiles

  • CCC(C)CC(C)/C=C(C)/C=C/C(=O)C[C@H]1C2=COC(=CC2=CC(=O)[C@]1(C)O)[C@@H]1[C@@H](C)C[C@@H](O)CC1=O

subset

  • 3_STAR

synonym EXACT

  • (7R,8S)-7-hydroxy-3-[(1S,2S,4R)-4-hydroxy-2-methyl-6-oxocyclohexyl]-7-methyl-8-[(3E,5E)-5,7,9-trimethyl-2-oxoundeca-3,5-dien-1-yl]-7,8-dihydro-6H-isochromen-6-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:68981

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