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Concept information

Preferred term

گانودرملاکتون I  

Type

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

Broader concept

charge

  • 0

formula

  • C30H40O6

inchi

  • InChI=1S/C30H40O6/c1-16-13-23(31)26(35-27(16)34)17(2)22-15-24(32)30(6)21-9-8-20-18(7-10-25(33)36-28(20,3)4)14-19(21)11-12-29(22,30)5/h7,10,13-14,17,20,22-24,26,31-32H,8-9,11-12,15H2,1-6H3/t17-,20+,22+,23-,24+,26+,29+,30+/m0/s1

inchikey

  • YFYJFZURUNKVJA-UXTWLTFPSA-N

mass

  • 496.644

monoisotopicmass

  • 496.28249

smiles

  • O=C1OC([C@@H]2CCC=3[C@]4([C@]([C@@H]([C@@H]([C@H]5OC(=O)C(C)=C[C@@H]5O)C)C[C@H]4O)(C)CCC3C=C2C=C1)C)(C)C

subset

  • 2_STAR

synonym EXACT

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

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:223497

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