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Concept information

Preferred term

لوهیچلین سی  

Type

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

Broader concept

charge

  • 0

formula

  • C46H75N11O19

inchi

  • InChI=1S/C46H75N11O19/c1-4-6-7-8-9-10-11-12-13-18-35(63)55-36(37(64)46(73)74)44(71)54-33(25-60)42(69)50-29(19-20-34(47)62)40(67)53-31(23-58)41(68)49-28(16-14-21-56(75)26(3)61)39(66)48-27(5-2)38(65)52-32(24-59)43(70)51-30-17-15-22-57(76)45(30)72/h5,10-11,28-33,36-37,58-60,64,75-76H,4,6-9,12-25H2,1-3H3,(H2,47,62)(H,48,66)(H,49,68)(H,50,69)(H,51,70)(H,52,65)(H,53,67)(H,54,71)(H,55,63)(H,73,74)/b11-10-,27-5-/t28-,29-,30+,31+,32+,33-,36+,37+/m0/s1

inchikey

  • INUZTVUOUNUWAD-TUHQHBOISA-N

mass

  • 1086.164

monoisotopicmass

  • 1085.52407

smiles

  • O=C1N(O)CCC[C@H]1NC(=O)[C@H](NC(=O)/C(/NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)CCC/C=C/CCCCCC)[C@@H](O)C(=O)O)CO)CCC(=O)N)CO)CCCN(O)C(=O)C)=C/C)CO

subset

  • 2_STAR

synonym EXACT

  • (2R,3R)-4-[[(2S)-1-[[(2S)-1-[[(2R)-1-[[(2S)-5-[acetyl(hydroxy)amino]-1-[[(Z)-1-[[(2R)-3-hydroxy-1-[[(3R)-1-hydroxy-2-oxopiperidin-3-yl]amino]-1-oxopropan-2-yl]amino]-1-oxobut-2-en-2-yl]amino]-1-oxopentan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-5-amino-1,5-dioxopentan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-3-[[(Z)-dodec-5-enoyl]amino]-2-hydroxy-4-oxobutanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:208643

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