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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 > carboxamide > peptide > microginin 527 methyl ester
organooxygen compound > carboxamide > peptide > microginin 527 methyl ester
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > peptide > microginin 527 methyl ester
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic amino compound > peptide > microginin 527 methyl ester
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > peptide > microginin 527 methyl ester

Preferred term

microginin 527 methyl ester  

Type

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

Broader concept

charge

  • 0

formula

  • C26H43N3O7S

inchi

  • InChI=1S/C26H43N3O7S/c1-5-6-7-8-9-10-20(27)23(31)25(33)29(2)22(15-16-37(4)35)24(32)28-21(26(34)36-3)17-18-11-13-19(30)14-12-18/h11-14,20-23,30-31H,5-10,15-17,27H2,1-4H3,(H,28,32)/t20-,21-,22-,23-,37?/m0/s1

inchikey

  • LMUKNGXVZWJANM-DHWRZQMWSA-N

mass

  • 541.700

monoisotopicmass

  • 541.28217

smiles

  • S(=O)(CC[C@H](N(C(=O)[C@@H](O)[C@@H](N)CCCCCCC)C)C(=O)N[C@H](C(=O)OC)CC1=CC=C(O)C=C1)C

subset

  • 2_STAR

synonym EXACT

  • methyl (2S)-2-[[(2S)-2-[[(2S,3S)-3-amino-2-hydroxydecanoyl]-methylamino]-4-methylsulinylbutanoyl]amino]-3-(4-hydroxyphenyl)propanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:221598

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