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Concept information

Preferred term

Aplysiatoxin، 17 debromo  

Type

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

Broader concept

charge

  • 0

formula

  • C32H48O10

inchi

  • InChI=1S/C32H48O10/c1-18(11-12-24(38-7)22-9-8-10-23(34)13-22)29-20(3)26-16-32(41-29)30(5,6)15-19(2)31(37,42-32)17-28(36)39-25(21(4)33)14-27(35)40-26/h8-10,13,18-21,24-26,29,33-34,37H,11-12,14-17H2,1-7H3

inchikey

  • REAZZDPREXHWNV-UHFFFAOYSA-N

mass

  • 592.726

monoisotopicmass

  • 592.32475

smiles

  • O1C23OC(O)(C(CC2(C)C)C)CC(OC(CC(OC(C3)C(C1C(CCC(OC)C4=CC(O)=CC=C4)C)C)=O)C(O)C)=O

subset

  • 2_STAR

synonym EXACT

  • 13-hydroxy-9-(1-hydroxyethyl)-3-[5-(3-hydroxyphenyl)-5-methoxypentan-2-yl]-4,14,16,16-tetramethyl-2,6,10,17-tetraoxatricyclo[11.3.1.11,5]octadecane-7,11-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:230869

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