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Concept information

Preferred term

Dtxsid30925075  

Type

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

charge

  • 0

formula

  • C21H30O8S

inchi

  • InChI=1S/C21H30O8S/c1-19-7-5-13(22)9-12(19)3-4-14-15-6-8-21(25,17(24)11-29-30(26,27)28)20(15,2)10-16(23)18(14)19/h9,14-16,18,23,25H,3-8,10-11H2,1-2H3,(H,26,27,28)/t14?,15?,16?,18?,19?,20?,21-/m0/s1

inchikey

  • JOVLCJDINAUYJW-OXPLYMOZSA-N

mass

  • 442.520

monoisotopicmass

  • 442.16614

smiles

  • S(OCC(=O)[C@]1(O)C2(C(C3C(C4(C(CC3)=CC(=O)CC4)C)C(O)C2)CC1)C)(O)(=O)=O

subset

  • 2_STAR

synonym EXACT

  • [2-[(17R)-11,17-dihydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] hydrogen sulate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:182395

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