Q-k-q-g-q-g-q-w-t-y-q-i-y-q-e-p

Structural Information

Molecular Formula

C₈₉H₁₂₈N₂₄O₂₈

SMILES

CC[C@H](C)[C@@H](C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N2CCC[C@H]2C(=O)O)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CC3=CC=C(C=C3)O)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CC4=CNC5=CC=CC=C54)NC(=O)[C@H](CCC(=O)N)NC(=O)CNC(=O)[C@H](CCC(=O)N)NC(=O)CNC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)N)N

InChI

InChI=1S/C89H128N24O28/c1-4-44(2)74(86(137)109-61(38-46-14-18-49(115)19-15-46)83(134)105-58(26-33-69(96)121)81(132)107-60(28-35-73(125)126)88(139)113-37-9-13-64(113)89(140)141)111-82(133)59(27-34-70(97)122)106-84(135)62(39-47-16-20-50(116)21-17-47)110-87(138)75(45(3)114)112-85(136)63(40-48-41-98-53-11-6-5-10-51(48)53)108-80(131)57(25-32-68(95)120)102-72(124)43-99-77(128)55(23-30-66(93)118)101-71(123)42-100-78(129)56(24-31-67(94)119)104-79(130)54(12-7-8-36-90)103-76(127)52(91)22-29-65(92)117/h5-6,10-11,14-21,41,44-45,52,54-64,74-75,98,114-116H,4,7-9,12-13,22-40,42-43,90-91H2,1-3H3,(H2,92,117)(H2,93,118)(H2,94,119)(H2,95,120)(H2,96,121)(H2,97,122)(H,99,128)(H,100,129)(H,101,123)(H,102,124)(H,103,127)(H,104,130)(H,105,134)(H,106,135)(H,107,132)(H,108,131)(H,109,137)(H,110,138)(H,111,133)(H,112,136)(H,125,126)(H,140,141)/t44-,45+,52-,54-,55-,56-,57-,58-,59-,60-,61-,62-,63-,64-,74-,75-/m0/s1

InChIKey

UNKWMSHJQUUIJV-VSZPDGSLSA-N

Compound name

(2S)-1-[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-5-amino-2-[[2-[[(2S)-5-amino-2-[[2-[[(2S)-5-amino-2-[[(2S)-6-amino-2-[[(2S)-2,5-diamino-5-oxopentanoyl]amino]hexanoyl]amino]-5-oxopentanoyl]amino]acetyl]amino]-5-oxopentanoyl]amino]acetyl]amino]-5-oxopentanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-hydroxybutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-5-oxopentanoyl]amino]-3-methylpentanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-5-oxopentanoyl]amino]-4-carboxybutanoyl]pyrrolidine-2-carboxylic acid

Related CIDs

• CID 16186089