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Concept information

organooxygen compound > polyketide > macrolide > talarodilactone a

Preferred term

talarodilactone a  

Type

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

Broader concept

charge

  • 0

formula

  • C31H32O12

inchi

  • InChI=1S/C31H32O12/c1-17-7-6-10-22(15-20(32)13-19-14-21(33)16-23(34)25(19)28(37)41-17)42-30(39)31(12-11-24(35)40-2)26(27(36)29(38)43-31)18-8-4-3-5-9-18/h3-5,8-9,14,16-17,22,33-34,36H,6-7,10-13,15H2,1-2H3/t17-,22-,31+/m0/s1

inchikey

  • FZQBVILAADTZJV-NQVYGRNNSA-N

mass

  • 596.585

monoisotopicmass

  • 596.18938

smiles

  • O=C1O[C@H](CCC[C@H](OC(=O)[C@@]2(OC(=O)C(=C2C3=CC=CC=C3)O)CCC(=O)OC)CC(CC=4C1=C(O)C=C(O)C4)=O)C

subset

  • 2_STAR

synonym EXACT

  • [(4S,8S)-14,16-dihydroxy-4-methyl-2,10-dioxo-3-oxabicyclo[10.4.0]hexadeca-1(12),13,15-trien-8-yl] (2R)-4-hydroxy-2-(3-methoxy-3-oxopropyl)-5-oxo-3-phenyluran-2-carboxylate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:212943

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