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Concept information

Preferred term

o-methyl-4-[(2',3',4'-tri-o-acetyl-alpha-l-rhamnosyloxy)benzyl]thiocarbamate  

Type

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

Broader concept

charge

  • 0

formula

  • C21H27NO9S

inchi

  • InChI=1S/C21H27NO9S/c1-11-17(28-12(2)23)18(29-13(3)24)19(30-14(4)25)20(27-11)31-16-8-6-15(7-9-16)10-22-21(32)26-5/h6-9,11,17-20H,10H2,1-5H3,(H,22,32)/t11-,17-,18+,19+,20-/m0/s1

inchikey

  • IIJDSGYHWDZVCW-FXCHBBSNSA-N

mass

  • 469.510

monoisotopicmass

  • 469.14065

smiles

  • S=C(OC)NCC1=CC=C(O[C@@H]2O[C@H]([C@H](OC(=O)C)[C@@H](OC(=O)C)[C@H]2OC(=O)C)C)C=C1

subset

  • 2_STAR

synonym EXACT

  • [(2S,3S,4R,5R,6S)-4,5-diacetyloxy-6-[4-[(methoxycarbothioylamino)methyl]phenoxy]-2-methyloxan-3-yl] acetate

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:197011

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