Acetyl-d(arg-arg-trp-arg-arg-arg-ile-tyr-tyr-arg)-nh2

Structural Information

Molecular Formula

C₇₃H₁₁₆N₃₀O₁₃

SMILES

CC[C@@H](C)[C@H](C(=O)N[C@H](CC1=CC=C(C=C1)O)C(=O)N[C@H](CC2=CC=C(C=C2)O)C(=O)N[C@H](CCCNC(=N)N)C(=O)N)NC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H](CC3=CNC4=CC=CC=C43)NC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H](CCCNC(=N)N)NC(=O)C

InChI

InChI=1S/C73H116N30O13/c1-4-39(2)57(67(116)102-55(36-42-23-27-45(106)28-24-42)65(114)100-54(35-41-21-25-44(105)26-22-41)64(113)95-48(58(74)107)15-7-29-87-68(75)76)103-63(112)53(20-12-34-92-73(85)86)98-60(109)50(17-9-31-89-70(79)80)97-61(110)51(18-10-32-90-71(81)82)99-66(115)56(37-43-38-93-47-14-6-5-13-46(43)47)101-62(111)52(19-11-33-91-72(83)84)96-59(108)49(94-40(3)104)16-8-30-88-69(77)78/h5-6,13-14,21-28,38-39,48-57,93,105-106H,4,7-12,15-20,29-37H2,1-3H3,(H2,74,107)(H,94,104)(H,95,113)(H,96,108)(H,97,110)(H,98,109)(H,99,115)(H,100,114)(H,101,111)(H,102,116)(H,103,112)(H4,75,76,87)(H4,77,78,88)(H4,79,80,89)(H4,81,82,90)(H4,83,84,91)(H4,85,86,92)/t39-,48-,49-,50-,51-,52-,53-,54-,55-,56-,57-/m1/s1

InChIKey

DJDZOHJHIOIESP-MRKFDOKNSA-N

Compound name

(2R,3R)-2-[[(2R)-2-[[(2R)-2-[[(2R)-2-[[(2R)-2-[[(2R)-2-[[(2R)-2-acetamido-5-carbamimidamidopentanoyl]amino]-5-carbamimidamidopentanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-5-carbamimidamidopentanoyl]amino]-5-carbamimidamidopentanoyl]amino]-5-carbamimidamidopentanoyl]amino]-N-[(2R)-1-[[(2R)-1-[[(2R)-1-amino-5-carbamimidamido-1-oxopentan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]-3-methylpentanamide

Related CIDs

• CID 16186504