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

Concept information

Preferred term

epicorazine a  

Type

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

charge

  • 0

formula

  • C18H16N2O6S2

inchi

  • InChI=1S/C18H16N2O6S2/c21-9-1-3-11(23)13-7(9)5-17-15(25)20-14-8(10(22)2-4-12(14)24)6-18(20,28-27-17)16(26)19(13)17/h1-4,7-8,11-14,23-24H,5-6H2/t7-,8-,11-,12+,13-,14-,17-,18-/m0/s1

inchikey

  • RCODXLGTKJXDNC-ZSWOQMQUSA-N

mass

  • 420.450

monoisotopicmass

  • 420.04498

smiles

  • S1S[C@@]23N([C@@H]4[C@@H](O)C=CC([C@@H]4C2)=O)C([C@@]15N([C@@H]6[C@H](O)C=CC([C@@H]6C5)=O)C3=O)=O

subset

  • 2_STAR

synonym EXACT

  • (1S,4S,5S,9R,11S,14S,15R,19R)-5,15-dihydroxy-21,22-dithia-3,13-diazahexacyclo[9.9.2.01,13.03,11.04,9.014,19]docosa-6,16-diene-2,8,12,18-tetrone

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:223710

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