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Concept information

Preferred term

sorokinianin  

Type

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

Broader concept

charge

  • 0

formula

  • C18H28O4

inchi

  • InChI=1S/C18H28O4/c1-9(2)11-5-6-18(4)10(3)15(16(11)12(18)8-19)14-7-13(20)17(21)22-14/h9,11-16,19-20H,3,5-8H2,1-2,4H3/t11-,12+,13-,14+,15?,16+,18+/m1/s1

inchikey

  • PTGFDIFCKGMAJK-HBBNERDWSA-N

mass

  • 308.418

monoisotopicmass

  • 308.19876

smiles

  • O=C1O[C@H](C2C(=C)[C@@]3(CC[C@@H]([C@H]2[C@@H]3CO)C(C)C)C)C[C@H]1O

subset

  • 2_STAR

synonym EXACT

  • (3R,5S)-3-hydroxy-5-[(1R,4R,5S,8S)-8-(hydroxymethyl)-1-methyl-7-methylidene-4-propan-2-yl-6-bicyclo[3.2.1]octanyl]oxolan-2-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:201038

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