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Concept information

Preferred term

پالمرولید B  

Type

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

Broader concept

charge

  • 0

formula

  • C33H48N2O10S

inchi

  • InChI=1S/C33H48N2O10S/c1-23(2)20-31(37)35-19-18-25(4)21-26(5)30-22-24(3)12-8-6-9-13-27(45-46(40,41)42)16-17-28(36)29(44-33(34)39)14-10-7-11-15-32(38)43-30/h6,8,11-12,15-21,26-30,36H,7,9-10,13-14,22H2,1-5H3,(H2,34,39)(H,35,37)(H,40,41,42)/b8-6+,15-11+,17-16-,19-18+,24-12+,25-21+/t26-,27+,28-,29+,30-/m1/s1

inchikey

  • FAWDDZFFIALADY-MNQAKPFUSA-N

mass

  • 664.810

monoisotopicmass

  • 664.30297

smiles

  • S(=O)(=O)(O[C@@H]1C=C[C@@H](O)[C@@H](OC(=O)N)CCCC=CC(=O)O[C@H](CC(=CC=CCC1)C)[C@@H](/C=C(/C=C/NC(=O)C=C(C)C)/C)C)O

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:223199

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