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Concept information

Preferred term

کلوبتائولاکتون D  

Type

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

Broader concept

charge

  • 0

formula

  • C30H40O5

inchi

  • InChI=1S/C30H40O5/c1-17-7-11-24(34-27(17)33)18(2)23-16-25(31)30(6)22-10-9-21-19(8-12-26(32)35-28(21,3)4)15-20(22)13-14-29(23,30)5/h7-8,12,15,18,21,23-25,31H,9-11,13-14,16H2,1-6H3/t18-,21+,23+,24?,25+,29+,30+/m0/s1

inchikey

  • MGEGUOWYQQSKHH-GBOCAVNRSA-N

mass

  • 480.645

monoisotopicmass

  • 480.28757

smiles

  • O=C1OC([C@@H]2CCC=3[C@]4([C@]([C@@H]([C@@H](C5OC(=O)C(C)=CC5)C)C[C@H]4O)(C)CCC3C=C2C=C1)C)(C)C

subset

  • 2_STAR

synonym EXACT

  • (9R,13R,14R,16R,17R)-14-hydroxy-8,8,13,17-tetramethyl-16-[(1S)-1-(5-methyl-6-oxo-2,3-dihydropyran-2-yl)ethyl]-7-oxatetracyclo[10.7.0.03,9.013,17]nonadeca-1(12),2,4-trien-6-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:221238

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