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Concept information

Preferred term

رسپینومایسین C  

Type

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

Broader concept

charge

  • 0

formula

  • C36H45NO14

inchi

  • InChI=1S/C36H45NO14/c1-13-28(42)35(3,45)31(47-8)33(48-13)50-27-18-14(12-34(2,44)30(27)46-7)11-16-19(23(18)39)24(40)20-15(22(16)38)9-10-17-26(20)49-32-25(41)21(37(5)6)29(43)36(17,4)51-32/h9-11,13,21,25,27-33,39,41-45H,12H2,1-8H3/t13?,21-,25-,27+,28?,29-,30+,31?,32-,33?,34+,35?,36-/m0/s1

inchikey

  • BZFHXAJTVQBODO-WJQQIYQJSA-N

mass

  • 715.749

monoisotopicmass

  • 715.28401

smiles

  • O=C1C2=C3O[C@H]4O[C@@](C3=CC=C2C(=O)C=5C1=C(O)C6=C(C[C@](O)(C)[C@@H]([C@@H]6OC7OC(C(O)C(C7OC)(O)C)C)OC)C5)([C@@H](O)[C@H]([C@@H]4O)N(C)C)C

subset

  • 2_STAR

synonym EXACT

  • (1S,11R,12R,13R,21S,22S,23R,24S)-13-(4,5-dihydroxy-3-methoxy-4,6-dimethyloxan-2-yl)oxy-23-(dimethylamino)-11,15,22,24-tetrahydroxy-12-methoxy-1,11-dimethyl-20,25-dioxahexacyclo[19.3.1.02,19.05,18.07,16.09,14]pentacosa-2(19),3,5(18),7(16),8,14-hexaene-6,17-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:223828

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