skip to main content

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

Preferred term

cochalate  

Type

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

charge

  • -1

formula

  • C30H47O4

inchi

  • InChI=1S/C30H48O4/c1-25(2)14-15-30(24(33)34)19(16-25)18-8-9-21-27(5)12-11-22(31)26(3,4)20(27)10-13-28(21,6)29(18,7)17-23(30)32/h8,19-23,31-32H,9-17H2,1-7H3,(H,33,34)/p-1/t19-,20-,21+,22-,23-,27-,28+,29+,30+/m0/s1

inchikey

  • YKOPWPOFWMYZJZ-FMMUPTMQSA-M

is_conjugate_base_of

mass

  • 471.693

monoisotopicmass

  • 471.34798

smiles

  • [C@@]12(C([C@@]3(CC(CC[C@@]3([C@H](C1)O)C([O-])=O)(C)C)[H])=CC[C@]4([C@]2(CC[C@@]5([C@@]4(CC[C@@H](C5(C)C)O)C)[H])C)[H])C

subset

  • 3_STAR

synonym EXACT

  • 3beta,16beta-dihydroxyolean-12-en-28-oate
  • cochalate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:138946

Download this concept: