Acetyl-d(ser-phe-met-arg-arg-arg-trp-arg-arg-arg)-nh2

Structural Information

Molecular Formula

C₆₆H₁₁₀N₃₀O₁₂S

SMILES

CC(=O)N[C@H](CO)C(=O)N[C@H](CC1=CC=CC=C1)C(=O)N[C@H](CCSC)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H](CC2=CNC3=CC=CC=C32)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N

InChI

InChI=1S/C66H110N30O12S/c1-36(98)87-50(35-97)60(108)95-48(32-37-14-4-3-5-15-37)58(106)94-47(24-31-109-2)57(105)92-44(21-11-28-83-64(74)75)54(102)90-43(20-10-27-82-63(72)73)53(101)91-46(23-13-30-85-66(78)79)56(104)96-49(33-38-34-86-40-17-7-6-16-39(38)40)59(107)93-45(22-12-29-84-65(76)77)55(103)89-42(19-9-26-81-62(70)71)52(100)88-41(51(67)99)18-8-25-80-61(68)69/h3-7,14-17,34,41-50,86,97H,8-13,18-33,35H2,1-2H3,(H2,67,99)(H,87,98)(H,88,100)(H,89,103)(H,90,102)(H,91,101)(H,92,105)(H,93,107)(H,94,106)(H,95,108)(H,96,104)(H4,68,69,80)(H4,70,71,81)(H4,72,73,82)(H4,74,75,83)(H4,76,77,84)(H4,78,79,85)/t41-,42-,43-,44-,45-,46-,47-,48-,49-,50-/m1/s1

InChIKey

ZJXAIASWUXMBFJ-CJYQPKNTSA-N

Compound name

(2R)-2-[[(2R)-2-[[(2R)-2-[[(2R)-2-[[(2R)-2-[[(2R)-2-[[(2R)-2-[[(2R)-2-[[(2R)-2-[[(2R)-2-acetamido-3-hydroxypropanoyl]amino]-3-phenylpropanoyl]amino]-4-methylsulfanylbutanoyl]amino]-5-carbamimidamidopentanoyl]amino]-5-carbamimidamidopentanoyl]amino]-5-carbamimidamidopentanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-5-carbamimidamidopentanoyl]amino]-5-carbamimidamidopentanoyl]amino]-5-carbamimidamidopentanamide

Related CIDs

• CID 16186512