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Concept information

Preferred term

پپتیدولیپین B  

Type

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

charge

  • 0

formula

  • C59H107N7O11

inchi

  • InChI=1S/C59H107N7O11/c1-12-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-35-45-38-47(68)61-51(43(9)67)57(73)63-48(39(3)4)54(70)60-42(8)58(74)66-37-34-36-46(66)53(69)64-50(41(7)13-2)56(72)62-49(40(5)6)55(71)65-52(44(10)76-11)59(75)77-45/h39-46,48-52,67H,12-38H2,1-11H3,(H,60,70)(H,61,68)(H,62,72)(H,63,73)(H,64,69)(H,65,71)/t41-,42-,43+,44+,45+,46+,48-,49-,50+,51-,52-/m0/s1

inchikey

  • AZLHFAKIYLIXEW-JWEYKXOCSA-N

mass

  • 1090.543

monoisotopicmass

  • 1089.80286

smiles

  • O=C1O[C@@H](CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C)C(N2[C@@H](C(N[C@@H](C(N[C@H](C(N[C@H]1[C@H](OC)C)=O)C(C)C)=O)[C@H](CC)C)=O)CCC2)=O)C(C)C)[C@H](O)C)CCCCCCCCCCCCCCCCCCCCCCC

subset

  • 2_STAR

synonym EXACT

  • (3S,6S,9S,13R,16S,19S,22R,25R)-22-[(2S)-butan-2-yl]-9-[(1R)-1-hydroxyethyl]-16-[(1R)-1-methoxyethyl]-3-methyl-6,19-di(propan-2-yl)-13-tricosyl-14-oxa-1,4,7,10,17,20,23-heptazabicyclo[23.3.0]octacosane-2,5,8,11,15,18,21,24-octone

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:220383

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