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Concept information

Preferred term

1آلفا، 25 دی هیدروکسی 2بتا (3 هیدروکسی پروپوکسی) ویتامین D3  

Type

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

charge

  • 0

formula

  • C30H50O5

has_functional_parent

inchi

  • InChI=1S/C30H50O5/c1-20(9-6-15-29(3,4)34)24-13-14-25-22(10-7-16-30(24,25)5)11-12-23-19-26(32)28(27(33)21(23)2)35-18-8-17-31/h11-12,20,24-28,31-34H,2,6-10,13-19H2,1,3-5H3/b22-11+,23-12-/t20-,24-,25+,26-,27-,28-,30-/m1/s1

inchikey

  • FZEXGDDBXLBRTD-AYIMTCTASA-N

mass

  • 490.71500

monoisotopicmass

  • 490.36582

smiles

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

subset

  • 3_STAR

synonym EXACT

  • (1R,2R,3R,5Z,7E)-2-(3-hydroxypropoxy)-9,10-secocholesta-5,7,10-triene-1,3,25-triol

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:73927

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