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Concept information

Preferred term

سفتیولن  

Type

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

Broader concept

charge

  • 0

formula

  • C20H18N8O8S3

inchi

  • InChI=1S/C20H18N8O8S3/c1-36-26-10(9-7-39-19(21)22-9)13(30)23-11-15(32)28-12(18(34)35)8(6-38-17(11)28)2-5-37-20-25-24-14(31)16(33)27(20)3-4-29/h2,4-5,7,11,17H,3,6H2,1H3,(H2,21,22)(H,23,30)(H,24,31)(H,34,35)/b5-2+,26-10-/t11-,17-/m1/s1

inchikey

  • WJXAHFZIHLTPFR-JLRJEBFFSA-N

mass

  • 594.590

monoisotopicmass

  • 594.04097

smiles

  • [H]C(=O)CN1C(=O)C(=O)NN=C1S/C=C/C1=C(N2C(=O)[C@@H](NC(=O)C(=N/OC)/C3=CSC(N)=N3)[C@@]2([H])SC1)C(O)=O

subset

  • 3_STAR

synonym EXACT

  • 3-[(E)-2-{[5,6-dioxo-4-(2-oxoethyl)-1,4,5,6-tetrahydro-1,2,4-triazin-3-yl]sulfanyl}ethenyl]-7beta-{[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetyl]amino}-3,4-didehydrocepham-4-carboxyic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:140116

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