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Concept information

Preferred term

سامباسین  

Type

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

Broader concept

charge

  • 0

formula

  • C26H36O12

inchi

  • InChI=1S/C26H36O12/c1-4-13-15-6-20(29)34-9-16-12(3)18(5-14(16)11(2)7-27)36-24(33)17(15)10-35-25(13)38-26-23(32)22(31)21(30)19(8-28)37-26/h4,6,10-12,14,16,18-19,21-23,25-28,30-32H,5,7-9H2,1-3H3/b13-4?,15-6+/t11-,12+,14-,16+,18+,19+,21+,22-,23+,25?,26-/m0/s1

inchikey

  • SIVWXOPASOMQQC-QRTIIMGYSA-N

mass

  • 540.562

monoisotopicmass

  • 540.22068

smiles

  • O1[C@]2([C@@H]([C@]([C@@](C2)([C@H](CO)C)[H])(COC(=O)C=C3C(C1=O)=COC(O[C@@H]4O[C@@H]([C@@H](O)[C@H](O)[C@H]4O)CO)C3=CC)[H])C)[H]

subset

  • 2_STAR

synonym EXACT

  • (1R,8E,9Z,14S,15S,17R)-8-ethylidene-15-[(2R)-1-hydroxypropan-2-yl]-17-methyl-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,6,12-trioxatricyclo[12.2.1.04,9]heptadeca-4,9-diene-3,11-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:177962

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