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Concept information

Preferred term

resinacein t  

Type

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

Broader concept

charge

  • 0

formula

  • C25H38O5

inchi

  • InChI=1S/C25H38O5/c1-13(12-26)14-9-19(30)25(6)21-15(27)10-17-22(2,3)18(29)7-8-23(17,4)20(21)16(28)11-24(14,25)5/h9,13,15,17-19,26-27,29-30H,7-8,10-12H2,1-6H3/t13-,15+,17+,18+,19+,23+,24-,25+/m1/s1

inchikey

  • DWQITYXXLSIYTI-YFCUDECBSA-N

mass

  • 418.574

monoisotopicmass

  • 418.27192

smiles

  • O=C1C2=C([C@@]3([C@@H](O)C=C([C@]3(C1)C)[C@@H](CO)C)C)[C@@H](O)C[C@@H]4[C@@]2(CC[C@@H](C4(C)C)O)C

subset

  • 2_STAR

synonym EXACT

  • (3S,5R,7S,10S,13R,14R,15S)-3,7,15-trihydroxy-17-[(2S)-1-hydroxypropan-2-yl]-4,4,10,13,14-pentamethyl-1,2,3,5,6,7,12,15-octahydrocyclopenta[a]phenanthren-11-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:205899

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