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Concept information

Preferred term

آئروژینوسین DA511  

Type

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

Broader concept

charge

  • 0

formula

  • C27H33N3O7

inchi

  • InChI=1S/C27H33N3O7/c28-25(35)23-13-17-5-10-20(33)14-22(17)30(23)27(37)21(11-15-1-6-18(31)7-2-15)29-26(36)24(34)12-16-3-8-19(32)9-4-16/h1-4,6-9,17,20-24,31-34H,5,10-14H2,(H2,28,35)(H,29,36)/t17-,20-,21+,22-,23-,24+/m0/s1

inchikey

  • UYAGLGONOYOGBB-QECFBVRUSA-N

mass

  • 511.575

monoisotopicmass

  • 511.23185

smiles

  • O=C(N)[C@H]1N(C(=O)[C@H](NC(=O)[C@H](O)CC2=CC=C(O)C=C2)CC3=CC=C(O)C=C3)[C@H]4C[C@@H](O)CC[C@H]4C1

subset

  • 2_STAR

synonym EXACT

  • (2S,3aS,6S,7aS)-6-hydroxy-1-[(2R)-2-[[(2R)-2-hydroxy-3-(4-hydroxyphenyl)propanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:200457

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