skip to main content

Content language

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

Concept information

Preferred term

میروپپتین A2  

Type

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

Broader concept

charge

  • 0

formula

  • C88H150N20O22

inchi

  • InChI=1S/C88H150N20O22/c1-27-28-29-30-31-32-33-34-35-42-58(110)96-86(21,22)75(128)107-48-37-40-55(107)65(118)99-84(17,18)73(126)105-88(25,26)77(130)108-49-38-41-56(108)66(119)100-83(15,16)72(125)104-87(23,24)76(129)106-47-36-39-54(106)64(117)93-53(4)63(116)97-78(5,6)67(120)89-45-43-57(109)92-52(3)62(115)98-82(13,14)71(124)101-79(7,8)68(121)90-46-44-59(111)95-81(11,12)70(123)103-85(19,20)74(127)102-80(9,10)69(122)94-51(2)61(114)91-50-60(112)113/h51-56H,27-50H2,1-26H3,(H,89,120)(H,90,121)(H,91,114)(H,92,109)(H,93,117)(H,94,122)(H,95,111)(H,96,110)(H,97,116)(H,98,115)(H,99,118)(H,100,119)(H,101,124)(H,102,127)(H,103,123)(H,104,125)(H,105,126)(H,112,113)/t51-,52-,53-,54-,55-,56-/m0/s1

inchikey

  • SVILHBHLAGERMJ-FMBXVYBVSA-N

mass

  • 1840.286

monoisotopicmass

  • 1839.12336

smiles

  • O=C(N1[C@H](C(=O)NC(C(=O)NC(C(=O)N2[C@H](C(=O)N[C@H](C(=O)NC(C(=O)NCCC(=O)N[C@H](C(=O)NC(C(=O)NC(C(=O)NCCC(=O)NC(C(=O)NC(C(=O)NC(C(=O)N[C@H](C(=O)NCC(=O)O)C)(C)C)(C)C)(C)C)(C)C)(C)C)C)(C)C)C)CCC2)(C)C)(C)C)CCC1)C(NC(=O)C(NC(=O)[C@H]3N(C(=O)C(NC(=O)CCCCCCCCCCC)(C)C)CCC3)(C)C)(C)C

subset

  • 2_STAR

synonym EXACT

  • 2-[[(2S)-2-[[2-[[2-[[2-[3-[[2-[[2-[[(2S)-2-[3-[[2-[[(2S)-2-[[(2S)-1-[2-[[2-[[(2S)-1-[2-[[2-[[(2S)-1-[2-(dodecanoylamino)-2-methylpropanoyl]pyrrolidine-2-carbonyl]amino]-2-methylpropanoyl]amino]-2-methylpropanoyl]pyrrolidine-2-carbonyl]amino]-2-methylpropanoyl]amino]-2-methylpropanoyl]pyrrolidine-2-carbonyl]amino]propanoyl]amino]-2-methylpropanoyl]amino]propanoylamino]propanoyl]amino]-2-methylpropanoyl]amino]-2-methylpropanoyl]amino]propanoylamino]-2-methylpropanoyl]amino]-2-methylpropanoyl]amino]-2-methylpropanoyl]amino]propanoyl]amino]acetic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:210028

Download this concept: