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Concept information

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

Preferred term

spinosyn d 17-pseudoaglycone  

Type

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

Broader concept

charge

  • 0

formula

  • C34H52O9

inchi

  • InChI=1S/C34H52O9/c1-8-20-10-9-11-28(35)18(3)30(37)27-15-25-23(26(27)16-29(36)42-20)12-17(2)22-13-21(14-24(22)25)43-34-33(40-7)32(39-6)31(38-5)19(4)41-34/h12,15,18-26,28,31-35H,8-11,13-14,16H2,1-7H3

inchikey

  • PGGPPEHRBUYMQU-UHFFFAOYSA-N

mass

  • 604.781

monoisotopicmass

  • 604.36113

smiles

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

subset

  • 2_STAR

synonym EXACT

  • (1S,2S,5R,7S,9S,10S,14R,15S,19S)-19-ethyl-15-hydroxy-4,14-dimethyl-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:201546

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