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Concept information

organooxygen compound > tiancilactone h

Preferred term

tiancilactone h  

Type

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

charge

  • 0

formula

  • C22H34O4

inchi

  • InChI=1S/C22H34O4/c1-12-10-14-19-21(4)9-7-16(23)20(2,3)15(21)6-8-22(19,5)18(12)13(26-14)11-17(24)25/h10,13-16,18-19,23H,6-9,11H2,1-5H3,(H,24,25)/t13-,14+,15-,16-,18+,19+,21-,22+/m0/s1

inchikey

  • VPYDKRNAPAGWFD-SMMGSXOKSA-N

mass

  • 362.510

monoisotopicmass

  • 362.24571

smiles

  • O=C(O)C[C@@H]1O[C@@H]2C=C([C@H]1[C@]3(CC[C@@H]4[C@@]([C@@H]23)(CC[C@@H](C4(C)C)O)C)C)C

subset

  • 2_STAR

synonym EXACT

  • 2-[(1R,2R,3S,6S,8R,11R,12S,13S)-6-hydroxy-3,7,7,11,16-pentamethyl-14-oxatetracyclo[10.2.2.02,11.03,8]hexadec-15-en-13-yl]acetic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:211729

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