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Concept information

Preferred term

colobetaolactone g  

Type

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

Broader concept

charge

  • 0

formula

  • C32H42O7

inchi

  • InChI=1S/C32H42O7/c1-18-8-10-25(38-28(18)35)19(2)24-17-26(37-20(3)33)31(7)23-13-15-32(36)22(9-11-27(34)39-29(32,4)5)16-21(23)12-14-30(24,31)6/h8-9,11,16,19,24-26,36H,10,12-15,17H2,1-7H3/t19-,24+,25?,26+,30+,31+,32?/m0/s1

inchikey

  • XJXZBYGMEHOTKU-CNSMAIHUSA-N

mass

  • 538.681

monoisotopicmass

  • 538.29305

smiles

  • O=C1OC(C2(O)CCC=3[C@]4([C@]([C@@H]([C@@H](C5OC(=O)C(C)=CC5)C)C[C@H]4OC(=O)C)(C)CCC3C=C2C=C1)C)(C)C

subset

  • 2_STAR

synonym EXACT

  • [(13R,14R,16R,17R)-9-hydroxy-8,8,13,17-tetramethyl-16-[(1S)-1-(5-methyl-6-oxo-2,3-dihydropyran-2-yl)ethyl]-6-oxo-7-oxatetracyclo[10.7.0.03,9.013,17]nonadeca-1(12),2,4-trien-14-yl] acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:219043

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