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Concept information

ترکیب اکسیژن ارگانیک > oxacycle > دی اکسان ها > اسپیروسوربی سیلینول B

Preferred term

اسپیروسوربی سیلینول B  

Type

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

Broader concept

charge

  • 0

formula

  • C25H28O10

inchi

  • InChI=1S/C25H28O10/c1-5-6-7-8-14(26)17-13-11-25(23(2,19(17)28)21(30)24(13,3)32)22(31)34-18-15(27)9-12(20(29)33-4)10-16(18)35-25/h5-9,13,15-16,18,26-27,32H,10-11H2,1-4H3/b6-5+,8-7+,17-14-/t13?,15-,16+,18+,23?,24-,25-/m0/s1

inchikey

  • UERHKENXDNOUAG-DCNJXBJSSA-N

mass

  • 488.489

monoisotopicmass

  • 488.16825

smiles

  • O=C1O[C@@H]2[C@@H](O)C=C(C(=O)OC)C[C@H]2O[C@]13C4(C(=O)/C(=C(/O)/C=C/C=C/C)/C(C3)[C@@](C4=O)(O)C)C

subset

  • 2_STAR

synonym EXACT

  • methyl (2R,4aR,5S,5'S,8'Z,8aR)-5,5'-dihydroxy-8'-[(2E,4E)-1-hydroxyhexa-2,4-dienylidene]-1',5'-dimethyl-3,6',7'-trioxospiro[4a,5,8,8a-tetrahydro-1,4-benzodioxine-2,2'-bicyclo[2.2.2]octane]-7-carboxylate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:202428

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