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Concept information

Preferred term

گانوسیننسیک اسید A  

Type

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

Broader concept

charge

  • 0

formula

  • C27H38O6

inchi

  • InChI=1S/C27H38O6/c1-13(7-8-20(31)32)14-9-19(30)26(6)21-15(28)10-16-23(2,3)18(29)11-17-25(16,5)22(21)27(17,33)12-24(14,26)4/h13-17,28,33H,7-12H2,1-6H3,(H,31,32)/t13-,14-,15+,16+,17+,24-,25-,26+,27-/m1/s1

inchikey

  • KNBIXJUWSSXAAS-XZDWODFWSA-N

mass

  • 458.595

monoisotopicmass

  • 458.26684

smiles

  • O=C1C([C@H]2[C@]3(C4=C([C@@]5(C(=O)C[C@@H]([C@]5(C[C@]4([C@H]3C1)O)C)[C@@H](CCC(=O)O)C)C)[C@H](C2)O)C)(C)C

subset

  • 2_STAR

synonym EXACT

  • (4R)-4-[(2R,3S,7R,9S,11R,14R,15R,17R)-9,17-dihydroxy-2,6,6,11,15-pentamethyl-5,12-dioxo-14-pentacyclo[8.7.0.02,7.03,17.011,15]heptadec-1(10)-enyl]pentanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:199122

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