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Concept information

Preferred term

heptemerone c  

Type

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

Broader concept

charge

  • 0

formula

  • C23H32O6

inchi

  • InChI=1S/C23H32O6/c1-12(2)16-18(27-6)19(25)23(26)20-17-14(11-28-20)15(29-13(3)24)7-8-21(17,4)9-10-22(16,23)5/h11-12,15-16,18,26H,7-10H2,1-6H3/t15-,16-,18+,21-,22+,23+/m0/s1

inchikey

  • SVOIENAOCYMFDG-UFFKPRAZSA-N

mass

  • 404.503

monoisotopicmass

  • 404.21989

smiles

  • O=C1[C@@]2(O)C=3OC=C4C3[C@](CC[C@@H]4OC(=O)C)(C)CC[C@]2(C)[C@H]([C@H]1OC)C(C)C

subset

  • 2_STAR

synonym EXACT

  • [(2S,4R,5R,6R,9R,12S)-2-hydroxy-4-methoxy-6,9-dimethyl-3-oxo-5-propan-2-yl-15-oxatetracyclo[7.6.1.02,6.013,16]hexadeca-1(16),13-dien-12-yl] acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:199864

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