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Concept information

Preferred term

هاپالوسیکلامید  

Type

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

charge

  • 0

formula

  • C25H26N6O4S2

inchi

  • InChI=1S/C25H26N6O4S2/c1-12-23-31-19(14(3)35-23)22(34)27-13(2)24-29-18(10-36-24)21(33)28-16(9-15-7-5-4-6-8-15)25-30-17(11-37-25)20(32)26-12/h4-8,10,12-13,16-17H,9,11H2,1-3H3,(H,26,32)(H,27,34)(H,28,33)/t12-,13+,16-,17-/m1/s1

inchikey

  • CFWGJXVIHMKTMC-DLTLXFJOSA-N

mass

  • 538.640

monoisotopicmass

  • 538.14570

smiles

  • S1C2=NC(=C1)C(=O)N[C@@H](C=3SC[C@@H](N3)C(=O)N[C@@H](C4=NC(C(N[C@H]2C)=O)=C(O4)C)C)CC5=CC=CC=C5

subset

  • 2_STAR

synonym EXACT

  • (1S,4R,11S,18R)-18-benzyl-4,7,11-trimethyl-6-oxa-13,20-dithia-3,10,17,22,23,24-hexazatetracyclo[17.2.1.15,8.112,15]tetracosa-5(24),7,12(23),14,19(22)-pentaene-2,9,16-trione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:204258

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