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Concept information

Preferred term

picrotin  

Type

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

charge

  • 0

formula

  • C15H18O7

has_functional_parent

inchi

  • InChI=1S/C15H18O7/c1-12(2,18)6-7-10(16)20-8(6)9-13(3)14(7,19)4-5-15(13,22-5)11(17)21-9/h5-9,18-19H,4H2,1-3H3/t5-,6+,7-,8-,9-,13-,14-,15+/m1/s1

inchikey

  • RYEFFICCPKWYML-QCGISDTRSA-N

mass

  • 310.300

monoisotopicmass

  • 310.10525

smiles

  • [C@]123[C@]4([C@@]([C@@H]5[C@H](C(O)(C)C)[C@H]([C@]4(OC1=O)[H])OC5=O)(O)C[C@]2(O3)[H])C

subset

  • 3_STAR

synonym EXACT

  • (1R,3R,5S,8S,9R,12S,13R,14S)-1-hydroxy-14-(2-hydroxypropan-2-yl)-13-methyl-4,7,10-trioxapentacyclo[6.4.1.1(9,12).0(3,5).0(5,13)]tetradecane-6,11-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:8205

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