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Chemistry, part 1

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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 > sperabillin a
organooxygen compound > sperabillin a

Preferred term

sperabillin a  

Type

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

Broader concept

charge

  • 0

formula

  • C15H27N5O3

has_functional_parent

inchi

  • InChI=1S/C15H27N5O3/c1-2-3-4-5-14(22)20-10-12(21)8-11(16)9-15(23)19-7-6-13(17)18/h2-5,11-12,21H,6-10,16H2,1H3,(H3,17,18)(H,19,23)(H,20,22)/b3-2-,5-4+/t11-,12-/m1/s1

inchikey

  • OAXPQNCOMDEHMJ-FHNIRRRCSA-N

mass

  • 325.413

monoisotopicmass

  • 325.21139

smiles

  • O=C(NC[C@H](O)C[C@@H](N)CC(=O)NCCC(=N)N)/C=C/C=C/C

subset

  • 2_STAR

synonym EXACT

  • (3R,5R)-3-amino-N-(3-amino-3-iminopropyl)-6-[[(2E,4Z)-hexa-2,4-dienoyl]amino]-5-hydroxyhexanamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:224582

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