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

Concept information

Preferred term

Halstoctacosanolide C  

Type

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

Broader concept

charge

  • 0

formula

  • C48H78O10

inchi

  • InChI=1S/C48H78O10/c1-11-41(50)38(10)45(54)27-39(49)20-17-30(2)26-36(8)46-29-44(53)33(5)16-14-12-13-15-32(4)43(52)28-40-21-19-37(9)48(56,58-40)24-23-31(3)25-35(7)42(51)22-18-34(6)47(55)57-46/h12-14,16-18,23,25,32-33,36-42,44-46,49-51,53-54,56H,11,15,19-22,24,26-29H2,1-10H3/b13-12-,16-14-,30-17+,31-23-,34-18-,35-25-

inchikey

  • WOCRMBMRJOSSHX-NKUGXYOMSA-N

mass

  • 815.142

monoisotopicmass

  • 814.55950

smiles

  • O=C1OC(C(C/C(=C/CC(O)CC(O)C(C(O)CC)C)/C)C)CC(O)C(C=CC=CCC(C(=O)CC2OC(CC=C(C=C(C(CC=C1C)O)C)C)(O)C(CC2)C)C)C

subset

  • 2_STAR

synonym EXACT

  • (3Z,5Z,9Z,17Z,19Z)-1,7,15-trihydroxy-4,6,10,16,22,28-hexamethyl-13-[(E)-7,9,11-trihydroxy-4,10-dimethyltridec-4-en-2-yl]-12,29-dioxabicyclo[23.3.1]nonacosa-3,5,9,17,19-pentaene-11,23-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:198269

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