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Concept information

Preferred term

کیبدلون بی رامنوزید  

Type

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

charge

  • 0

formula

  • C35H36ClNO14

inchi

  • InChI=1S/C35H36ClNO14/c1-5-6-13-22(36)18-19(34(47)37(13)3)26(42)16-11(24(18)40)7-8-12-17(16)27(43)21-28(44)20-25(41)15(9-14(38)32(20)51-33(21)31(12)48-4)50-35-30(46)29(45)23(39)10(2)49-35/h10,14-15,23,25,29-30,35,38-39,41,43,45-46H,5-9H2,1-4H3/t10-,14+,15+,23-,25+,29+,30+,35-/m1/s1

inchikey

  • GNHBMFNCGFYQQR-BQKZIZRYSA-N

mass

  • 730.120

monoisotopicmass

  • 729.18243

smiles

  • ClC=1C=2C(=O)C3=C(C4=C(O)C=5C(=O)C6=C([C@@H](O)C[C@@H]([C@@H]6O)O[C@H]7O[C@@H]([C@@H](O)[C@@H]([C@@H]7O)O)C)OC5C(=C4CC3)OC)C(C2C(=O)N(C1CCC)C)=O

subset

  • 2_STAR

synonym EXACT

  • (19S,21S,22R)-8-chloro-19,22,26-trihydroxy-15-methoxy-6-methyl-7-propyl-21-[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-17-oxa-6-azahexacyclo[12.12.0.02,11.04,9.016,25.018,23]hexacosa-1(14),2(11),4(9),7,15,18(23),25-heptaene-3,5,10,24-tetrone

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:221282

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