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Concept information

Preferred term

betulinic acid  

Type

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

alt_id

  • CHEBI:65491

charge

  • 0

formula

  • C30H48O3

has_parent_hydride

inchi

  • InChI=1S/C30H48O3/c1-18(2)19-10-15-30(25(32)33)17-16-28(6)20(24(19)30)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h19-24,31H,1,8-17H2,2-7H3,(H,32,33)/t19-,20+,21-,22+,23-,24+,27-,28+,29+,30-/m0/s1

inchikey

  • QGJZLNKBHJESQX-FZFNOLFKSA-N

mass

  • 456.70030

monoisotopicmass

  • 456.36035

smiles

  • [H][C@]12CC[C@]3([H])[C@@]4(C)CC[C@H](O)C(C)(C)[C@]4([H])CC[C@@]3(C)[C@]1(C)CC[C@]1(CC[C@@H](C(C)=C)[C@]21[H])C(O)=O

subset

  • 3_STAR

synonym EXACT

  • 3beta-hydroxylup-20(29)-en-28-oic acid
  • Betulinic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:3087

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