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

Concept information

Preferred term

himalomycin a  

Type

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

Broader concept

charge

  • 0

formula

  • C43H52O16

inchi

  • InChI=1S/C43H52O16/c1-18-26(44)10-12-33(53-18)57-28-11-13-34(54-20(28)3)59-43(5,17-32(46)47)16-22-6-7-24-35(37(22)48)39(50)25-9-8-23(38(49)36(25)40(24)51)29-15-30-41(21(4)52-29)58-42-31(56-30)14-27(45)19(2)55-42/h6-9,18-21,26,28-31,33-34,41-42,44,48-49H,10-17H2,1-5H3,(H,46,47)

inchikey

  • FMYXTIDKAKTSDI-UHFFFAOYSA-N

mass

  • 824.873

monoisotopicmass

  • 824.32554

smiles

  • O=C1C2=C(O)C(=CC=C2C(=O)C3=C1C=CC(=C3O)CC(OC4OC(C(OC5OC(C(O)CC5)C)CC4)C)(CC(=O)O)C)C6OC(C7OC8OC(C)C(CC8OC7C6)=O)C

subset

  • 2_STAR

synonym EXACT

  • 4-[6-(5,14-dimethyl-6-oxo-2,4,9,13-tetraoxatricyclo[8.4.0.03,8]tetradecan-12-yl)-1,5-dihydroxy-9,10-dioxoanthracen-2-yl]-3-[5-(5-hydroxy-6-methyloxan-2-yl)oxy-6-methyloxan-2-yl]oxy-3-methylbutanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:204376

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