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Concept information

Preferred term

saponaceolide j  

Type

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

Broader concept

charge

  • 0

formula

  • C30H44O6

inchi

  • InChI=1S/C30H44O6/c1-20-7-10-23(26(2,3)24(20)12-9-22-14-18-33-25(22)31)11-8-21-13-15-30(34-19-21)28(6)16-17-29(32,36-30)27(4,5)35-28/h8-9,23-24,32H,1,7,10-19H2,2-6H3/t23-,24-,28-,29-,30-/m0/s1

inchikey

  • QTTVDCGWGAUSBO-IHIHHSMVSA-N

mass

  • 500.676

monoisotopicmass

  • 500.31379

smiles

  • O=C1OCCC1=CC[C@H]2C(=C)CC[C@H](C2(C)C)CC=C3CO[C@]4(O[C@]5(O)C(C)(C)O[C@]4(CC5)C)CC3

subset

  • 2_STAR

synonym EXACT

  • 3-[2-[(1S,3S)-3-[2-[(1S,3S,4S)-1-hydroxy-4,6,6-trimethylspiro[2,5-dioxabicyclo[2.2.2]octane-3,6'-oxane]-3'-ylidene]ethyl]-2,2-dimethyl-6-methylidenecyclohexyl]ethylidene]oxolan-2-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:204723

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