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Chemistry, part 1

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > chetocochliodin i
organooxygen compound > chetocochliodin i

Preferred term

chetocochliodin i  

Type

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

Broader concept

charge

  • 0

formula

  • C16H17N3O3S4

has_functional_parent

inchi

  • InChI=1S/C16H17N3O3S4/c1-18-14(22)16(9-20)19(2)13(21)15(18,26(16)25-24-23)7-10-8-17-12-6-4-3-5-11(10)12/h3-6,8,17,20H,7,9H2,1-2H3/t15-,16-,26?/m0/s1

inchikey

  • TYBHREIJLQFQJG-ZIZWBSLWSA-N

mass

  • 427.570

monoisotopicmass

  • 427.01528

smiles

  • S(=S=S)=S1[C@@]2(N(C)C([C@]1(N(C)C2=O)CC=3C4=C(C=CC=C4)NC3)=O)CO

subset

  • 2_STAR

synonym EXACT

  • (1S,4S)-1-(hydroxymethyl)-4-(1H-indol-3-ylmethyl)-2,5-dimethyl-7-[(sulanylidene-lambda4-sulanylidene)-lambda4-sulanylidene]-7lambda4-thia-2,5-diazabicyclo[2.2.1]heptane-3,6-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:224139

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