Aettsfsltkfvpdel

Structural Information

Molecular Formula

C₈₁H₁₂₅N₁₇O₂₈

SMILES

C[C@H]([C@@H](C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H](C(C)C)C(=O)N3CCC[C@H]3C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)N)O

InChI

InChI=1S/C81H125N17O28/c1-39(2)32-51(87-74(118)56(37-99)92-70(114)52(34-46-20-13-11-14-21-46)89-75(119)57(38-100)93-78(122)64(44(9)102)97-79(123)65(45(10)103)95-69(113)50(27-29-60(106)107)84-66(110)42(7)83)72(116)96-63(43(8)101)77(121)86-48(24-17-18-30-82)67(111)88-53(35-47-22-15-12-16-23-47)73(117)94-62(41(5)6)80(124)98-31-19-25-58(98)76(120)90-54(36-61(108)109)71(115)85-49(26-28-59(104)105)68(112)91-55(81(125)126)33-40(3)4/h11-16,20-23,39-45,48-58,62-65,99-103H,17-19,24-38,82-83H2,1-10H3,(H,84,110)(H,85,115)(H,86,121)(H,87,118)(H,88,111)(H,89,119)(H,90,120)(H,91,112)(H,92,114)(H,93,122)(H,94,117)(H,95,113)(H,96,116)(H,97,123)(H,104,105)(H,106,107)(H,108,109)(H,125,126)/t42-,43+,44+,45+,48-,49-,50-,51-,52-,53-,54-,55-,56-,57-,58-,62-,63-,64-,65-/m0/s1

InChIKey

DHKZHXVJZLGNRL-NAGARGIQSA-N

Compound name

(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-4-carboxybutanoyl]amino]-3-hydroxybutanoyl]amino]-3-hydroxybutanoyl]amino]-3-hydroxypropanoyl]amino]-3-phenylpropanoyl]amino]-3-hydroxypropanoyl]amino]-4-methylpentanoyl]amino]-3-hydroxybutanoyl]amino]hexanoyl]amino]-3-phenylpropanoyl]amino]-3-methylbutanoyl]pyrrolidine-2-carbonyl]amino]-3-carboxypropanoyl]amino]-4-carboxybutanoyl]amino]-4-methylpentanoic acid

Related CIDs

• CID 49777572