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Contact us: CRM@email.irandoc.ac.ir

Concept information

Preferred term

microsporin a  

Type

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

Broader concept

charge

  • 0

formula

  • C28H40N4O5

inchi

  • InChI=1S/C28H40N4O5/c1-3-21(33)14-8-5-9-15-22-26(35)29-19(2)25(34)31-23(18-20-12-6-4-7-13-20)28(37)32-17-11-10-16-24(32)27(36)30-22/h4,6-7,12-13,19,22-24H,3,5,8-11,14-18H2,1-2H3,(H,29,35)(H,30,36)(H,31,34)/t19-,22-,23-,24+/m0/s1

inchikey

  • DEUCVOIWOGPZGS-ZNEWLNCYSA-N

mass

  • 512.651

monoisotopicmass

  • 512.29987

smiles

  • O=C1N2[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(N[C@H]1CC3=CC=CC=C3)=O)C)CCCCCC(=O)CC)CCCC2

subset

  • 2_STAR

synonym EXACT

  • (3S,6S,9S,12R)-3-benzyl-6-methyl-9-(6-oxooctyl)-1,4,7,10-tetrazabicyclo[10.4.0]hexadecane-2,5,8,11-tetrone

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:226740

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