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Concept information

organooxygen compound > polyketide > macrolide > spinosyn a 17-pseudoaglycone
... > organooxygen compound > ester > lactone > macrocyclic lactone > macrolide > spinosyn a 17-pseudoaglycone
... > organooxygen compound > oxacycle > lactone > macrocyclic lactone > macrolide > spinosyn a 17-pseudoaglycone

Preferred term

spinosyn a 17-pseudoaglycone  

Type

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

Broader concept

charge

  • 0

formula

  • C33H50O9

inchi

  • InChI=1S/C33H50O9/c1-7-20-9-8-10-27(34)17(2)29(36)26-15-24-22(25(26)16-28(35)41-20)12-11-19-13-21(14-23(19)24)42-33-32(39-6)31(38-5)30(37-4)18(3)40-33/h11-12,15,17-25,27,30-34H,7-10,13-14,16H2,1-6H3

inchikey

  • KSCLXDPNSMLYPU-UHFFFAOYSA-N

mass

  • 590.754

monoisotopicmass

  • 590.34548

smiles

  • O=C1C2=CC3C4C(CC(C4)OC5OC(C(OC)C(C5OC)OC)C)C=CC3C2CC(=O)OC(CC)CCCC(C1C)O

subset

  • 2_STAR

synonym EXACT

  • (1S,2R,5S,7R,9R,10S,14R,15S,19S)-19-ethyl-15-hydroxy-14-methyl-7-[(2R,3R,4R,5S,6S)-3,4,5-trimethoxy-6-methyloxan-2-yl]oxy-20-oxatetracyclo[10.10.0.02,10.05,9]docosa-3,11-diene-13,21-dione

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:201545

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