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Concept information

Preferred term

Seco Chaetomugilin A  

Type

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

charge

  • 0

formula

  • C24H31ClO8

inchi

  • InChI=1S/C24H31ClO8/c1-11(13(3)26)7-8-15-9-16-17(10-32-15)18-19(22(29)31-6)24(30,12(2)14(4)27)33-23(18,5)21(28)20(16)25/h7-14,18-19,26-27,30H,1-6H3/b8-7+/t11-,12-,13-,14-,18-,19+,23+,24-/m1/s1

inchikey

  • FROQHXMNGOHAAZ-NCCWVHROSA-N

mass

  • 482.950

monoisotopicmass

  • 482.17075

smiles

  • ClC1=C2C(=COC(=C2)/C=C/[C@H]([C@H](O)C)C)[C@@H]3[C@@H](C(=O)OC)[C@@](O[C@@]3(C1=O)C)(O)[C@@H]([C@H](O)C)C

subset

  • 2_STAR

synonym EXACT

  • methyl (6aS,8R,9R,9aS)-5-chloro-8-hydroxy-8-[(2R,3R)-3-hydroxybutan-2-yl]-3-[(E,3R,4R)-4-hydroxy-3-methylpent-1-enyl]-6a-methyl-6-oxo-9,9a-dihydrouro[2,3-h]isochromene-9-carboxylate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:206163

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