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Concept information

Preferred term

monacolin p  

Type

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

Broader concept

charge

  • 0

formula

  • C26H44O8

inchi

  • InChI=1S/C26H44O8/c1-7-14(2)26(31)34-22-10-15(3)25(30)20-13-21(32-5)16(4)19(24(20)22)9-8-17(27)11-18(28)12-23(29)33-6/h13-19,21-22,24-25,27-28,30H,7-12H2,1-6H3/t14?,15-,16-,17+,18+,19+,21-,22+,24-,25-/m1/s1

inchikey

  • HEXISAIDDNYBOX-BIZSTCAJSA-N

mass

  • 484.630

monoisotopicmass

  • 484.30362

smiles

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

subset

  • 2_STAR

synonym EXACT

  • methyl (3S,5S)-7-[(1S,2R,3S,5R,6R,8S,8aR)-5-hydroxy-3-methoxy-2,6-dimethyl-8-(2-methylbutanoyloxy)-1,2,3,5,6,7,8,8a-octahydronaphthalen-1-yl]-3,5-dihydroxyheptanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:207610

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