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Concept information

Preferred term

raocyclamide b  

Type

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

Broader concept

charge

  • 0

formula

  • C27H32N6O6S

inchi

  • InChI=1S/C27H32N6O6S/c1-4-14(2)21-27-32-20(13-40-27)25(38)29-17(10-16-8-6-5-7-9-16)22(35)30-18(11-34)23(36)28-15(3)26-31-19(12-39-26)24(37)33-21/h5-9,12-15,17-18,21,34H,4,10-11H2,1-3H3,(H,28,36)(H,29,38)(H,30,35)(H,33,37)/t14-,15-,17+,18+,21?/m0/s1

inchikey

  • YHWCLQASEOOYBT-ZUTXQSCOSA-N

mass

  • 568.650

monoisotopicmass

  • 568.21040

smiles

  • S1C2=NC(=C1)C(=O)N[C@@H](C(=O)N[C@@H](C(=O)N[C@H](C3=NC(C(NC2[C@H](CC)C)=O)=CO3)C)CO)CC4=CC=CC=C4

subset

  • 2_STAR

synonym EXACT

  • (11R,14R,17S)-11-benzyl-4-[(2S)-butan-2-yl]-14-(hydroxymethyl)-17-methyl-19-oxa-6-thia-3,10,13,16,21,22-hexazatricyclo[16.2.1.15,8]docosa-1(20),5(22),7,18(21)-tetraene-2,9,12,15-tetrone

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:209468

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