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Concept information

Preferred term

کلسیتروت  

Type

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

charge

  • -1

formula

  • C23H33O4

inchi

  • InChI=1S/C23H34O4/c1-14(11-22(26)27)19-8-9-20-16(5-4-10-23(19,20)3)6-7-17-12-18(24)13-21(25)15(17)2/h6-7,14,18-21,24-25H,2,4-5,8-13H2,1,3H3,(H,26,27)/p-1/b16-6+,17-7-/t14-,18-,19-,20+,21+,23-/m1/s1

inchikey

  • MBLYZRMZFUWLOZ-ZTIKAOTBSA-M

is_conjugate_base_of

mass

  • 373.50570

monoisotopicmass

  • 373.23843

smiles

  • [H][C@@]1(CC[C@@]2([H])/C(CCC[C@]12C)=C/C=C1/C[C@@H](O)C[C@H](O)C1=C)[C@H](C)CC([O-])=O

subset

  • 3_STAR

synonym EXACT

  • (1S,3R,5Z,7E)-1,3-dihydroxy-24-nor-9,10-secochola-5,7,10(19)-trien-23-oate
  • calcitroate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:58715

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