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Concept information

Preferred term

لیتوکارول ای  

Type

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

Broader concept

charge

  • 0

formula

  • C29H38O7

inchi

  • InChI=1S/C29H38O7/c1-16(2)9-10-19-11-12-21(30)24-25(19)29(32-8,36-27(24)34-17(3)4)20-13-18(5)14-22-26(20)35-23(15-33-22)28(6,7)31/h9,11-14,17,23,27,30-31H,10,15H2,1-8H3/t23-,27+,29+/m0/s1

inchikey

  • KZAXBQHOLOTAJP-TZIIFLTASA-N

mass

  • 498.616

monoisotopicmass

  • 498.26175

smiles

  • O1C2=C(OC[C@H]1C(O)(C)C)C=C(C)C=C2[C@]3(O[C@@H](OC(C)C)C=4C3=C(C=CC4O)CC=C(C)C)OC

subset

  • 2_STAR

synonym EXACT

  • (1S,3R)-1-[(3S)-3-(2-hydroxypropan-2-yl)-7-methyl-2,3-dihydro-1,4-benzodioxin-5-yl]-1-methoxy-7-(3-methylbut-2-enyl)-3-propan-2-yloxy-3H-2-benzouran-4-ol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:210559

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