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Concept information

ترکیب اکسیژن ارگانیک > مروترپنوئید > دهیدروآستینول

Preferred term

دهیدروآستینول  

Type

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

Broader concept

charge

  • 0

formula

  • C25H28O8

inchi

  • InChI=1S/C25H28O8/c1-12-21(7)16(27)24-13(2)22(9-8-15(26)31-19(22,4)5)11-10-20(24,6)23(12)17(28)30-14(3)25(23,33-24)18(29)32-21/h8-9,14,16,27H,1-2,10-11H2,3-7H3/t14-,16-,20-,21+,22+,23+,24+,25-/m0/s1

inchikey

  • IQBUQLYYAHHCGX-LRSNFHFMSA-N

mass

  • 456.48500

monoisotopicmass

  • 456.17842

smiles

  • C[C@@H]1OC(=O)[C@@]23C(=C)[C@@]4(C)OC(=O)[C@@]12O[C@@]1([C@H]4O)C(=C)[C@]2(CC[C@@]31C)C=CC(=O)OC2(C)C

subset

  • 3_STAR

synonym EXACT

  • (1'R,2'S,3S,7'S,8'S,9'R,12'S,13'S)-8'-hydroxy-2,2,2',9',13'-pentamethyl-6',16'-bis(methylene)-6H-spiro[pyran-3,5'-[10,14,17]trioxapentacyclo[7.6.1.1(7,12).0(1,12).0(2,7)]heptadecane]-6,11',15'-trione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:64421

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