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Concept information

Preferred term

f1839-e  

Type

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

Broader concept

charge

  • 0

formula

  • C25H35NO6

inchi

  • InChI=1S/C25H35NO6/c1-13-5-6-19-23(2,3)21(30)18(29)11-24(19,4)25(13)10-15-17(28)9-14-16(20(15)32-25)12-26(7-8-27)22(14)31/h9,13,18-19,21,27-30H,5-8,10-12H2,1-4H3/t13-,18-,19+,21-,24+,25-/m1/s1

inchikey

  • PAILZINGRRXKCY-RNIWIPBASA-N

mass

  • 445.556

monoisotopicmass

  • 445.24644

smiles

  • O=C1N(CC2=C1C=C(O)C3=C2O[C@]4([C@@]5([C@H](C([C@H](O)[C@@H](C5)O)(C)C)CC[C@H]4C)C)C3)CCO

subset

  • 2_STAR

synonym EXACT

  • (2R,3S,4aS,7R,8R,8aS)-2,3,4'-trihydroxy-7'-(2-hydroxyethyl)-4,4,7,8a-tetramethylspiro[2,3,4a,5,6,7-hexahydro-1H-naphthalene-8,2'-3,8-dihydrouro[2,3-e]isoindole]-6'-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:225603

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