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

Concept information

Preferred term

Aigialomycin A  

Type

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

charge

  • 0

formula

  • C19H22O8

inchi

  • InChI=1S/C19H22O8/c1-9-4-3-5-12(20)17(23)14(22)8-15-18(27-15)11-6-10(25-2)7-13(21)16(11)19(24)26-9/h3,5-7,9,14-15,17-18,21-23H,4,8H2,1-2H3/b5-3+/t9-,14-,15+,17+,18+/m0/s1

inchikey

  • SSNQAUBBJYCSMY-FZVFXEOBSA-N

mass

  • 378.377

monoisotopicmass

  • 378.13147

smiles

  • O=C1O[C@H](CC=CC(=O)[C@@H](O)[C@H](C[C@@H]2[C@@H](C=3C1=C(O)C=C(OC)C3)O2)O)C

subset

  • 2_STAR

synonym EXACT

  • (2R,4R,6S,7S,9E,12S)-6,7,16-trihydroxy-18-methoxy-12-methyl-3,13-dioxatricyclo[13.4.0.02,4]nonadeca-1(15),9,16,18-tetraene-8,14-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:220223

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