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Concept information

Preferred term

pseudodesmin c  

Type

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

Broader concept

charge

  • 0

formula

  • C54H98N10O16

inchi

  • InChI=1S/C54H98N10O16/c1-13-15-16-17-18-19-34(68)25-42(70)56-36(22-28(3)4)47(72)57-35(20-21-41(55)69)46(71)64-45(33(12)67)53(78)62-43(31(9)10)52(77)59-38(24-30(7)8)49(74)60-39(26-65)50(75)58-37(23-29(5)6)48(73)61-40(27-66)51(76)63-44(54(79)80)32(11)14-2/h28-40,43-45,65-68H,13-27H2,1-12H3,(H2,55,69)(H,56,70)(H,57,72)(H,58,75)(H,59,77)(H,60,74)(H,61,73)(H,62,78)(H,63,76)(H,64,71)(H,79,80)/t32-,33+,34+,35+,36-,37-,38+,39+,40+,43+,44-,45+/m0/s1

inchikey

  • JEPCIKXNEFNAJI-YCDXGENYSA-N

mass

  • 1143.432

monoisotopicmass

  • 1142.71623

smiles

  • O=C(O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@H](NC(=O)[C@H](NC(=O)[C@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)C[C@H](O)CCCCCCC)CC(C)C)CCC(=O)N)[C@H](O)C)C(C)C)CC(C)C)CO)CC(C)C)CO)[C@H](CC)C

subset

  • 2_STAR

synonym EXACT

  • (2S,3S)-2-[[(2R)-2-[[(2S)-2-[[(2R)-2-[[(2R)-2-[[(2R)-2-[[(2R,3R)-2-[[(2R)-5-amino-2-[[(2S)-2-[[(3R)-3-hydroxydecanoyl]amino]-4-methylpentanoyl]amino]-5-oxopentanoyl]amino]-3-hydroxybutanoyl]amino]-3-methylbutanoyl]amino]-4-methylpentanoyl]amino]-3-hydroxypropanoyl]amino]-4-methylpentanoyl]amino]-3-hydroxypropanoyl]amino]-3-methylpentanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:213273

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