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Concept information

Preferred term

سیکلوپاسیفلوئیک اسید D  

Type

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

Broader concept

charge

  • 0

formula

  • C30H48O6

inchi

  • InChI=1S/C30H48O6/c1-16(2)19(31)13-20(32)17(3)18-9-10-27(5)21-7-8-22-28(6,25(35)36)23(33)14-24(34)30(22)15-29(21,30)12-11-26(18,27)4/h16-18,20-24,32-34H,7-15H2,1-6H3,(H,35,36)/t17-,18+,20+,21-,22-,23-,24-,26+,27-,28-,29-,30+/m0/s1

inchikey

  • ULQMFCLUVWBZLS-HDJSFYPOSA-N

mass

  • 504.708

monoisotopicmass

  • 504.34509

smiles

  • O[C@@H]1[C@@]23[C@@]4(C2)[C@]([C@]5([C@](CC4)([C@](CC5)([C@@H]([C@H](O)CC(=O)C(C)C)C)[H])C)C)(CC[C@]3([C@]([C@@H](O)C1)(C)C(O)=O)[H])[H]

subset

  • 2_STAR

synonym EXACT

  • (1S,3S,4S,6S,7S,8R,11S,12S,15R,16R)-4,6-dihydroxy-15-[(2S,3R)-3-hydroxy-6-methyl-5-oxoheptan-2-yl]-7,12,16-trimethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecane-7-carboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:168155

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