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Concept information

Preferred term

aspewentin i  

Type

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

Broader concept

charge

  • 0

formula

  • C19H26O3

inchi

  • InChI=1S/C19H26O3/c1-5-18(4)10-7-12-15(16(18)21)13(20)11-14-17(2,3)8-6-9-19(12,14)22/h5,11,16,21-22H,1,6-10H2,2-4H3/t16-,18-,19+/m0/s1

inchikey

  • LPJQROAWMVXSMD-YTQUADARSA-N

mass

  • 302.414

monoisotopicmass

  • 302.18819

smiles

  • O=C1C2=C([C@]3(O)CCCC(C3=C1)(C)C)CC[C@@]([C@H]2O)(C=C)C

subset

  • 2_STAR

synonym EXACT

  • (4aR,7R,8R)-7-ethenyl-4a,8-dihydroxy-1,1,7-trimethyl-2,3,4,5,6,8-hexahydrophenanthren-9-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:209209

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