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Concept information

Preferred term

sq-02-s-v1  

Type

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

Broader concept

charge

  • 0

formula

  • C30H41NO7

inchi

  • InChI=1S/C30H41NO7/c1-15(2)24(27(35)36)31-14-20-18(26(31)34)12-21(33)19-13-29(7)16(3)8-9-22-28(5,6)23(37-17(4)32)10-11-30(22,29)38-25(19)20/h12,15-16,22-24,33H,8-11,13-14H2,1-7H3,(H,35,36)/t16-,22-,23-,24?,29+,30-/m0/s1

inchikey

  • BVEXIWYXUHMACH-ZSPGBESWSA-N

mass

  • 527.658

monoisotopicmass

  • 527.28830

smiles

  • O=C1N(C(C(=O)O)C(C)C)CC2=C1C=C(O)C3=C2O[C@]45[C@]([C@H](CC[C@H]4C([C@@H](OC(=O)C)CC5)(C)C)C)(C)C3

subset

  • 2_STAR

synonym EXACT

  • 2-[(1S,13R,14S,17S,19S)-19-acetyloxy-10-hydroxy-13,14,18,18-tetramethyl-7-oxo-2-oxa-6-azapentacyclo[11.8.0.01,17.03,11.04,8]henicosa-3,8,10-trien-6-yl]-3-methylbutanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:204651

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