(d-arg6,azagly10)-lhrh ii

Structural Information

Molecular Formula

C₆₃H₇₇N₂₁O₁₃

SMILES

C1C[C@H](N(C1)C(=O)[C@H](CC2=CC=C(C=C2)O)NC(=O)[C@H](CC3=CNC4=CC=CC=C43)NC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@H](CC5C=NC=N5)NC(=O)[C@H](CO)NC(=O)[C@H](CC6=CNC7=CC=CC=C76)NC(=O)[C@H](CC8C=NC=N8)NC(=O)[C@@H]9CCC(=O)N9)C(=O)NNC(=O)N

InChI

InChI=1S/C63H77N21O13/c64-62(65)69-19-5-11-43(53(88)76-45(22-34-26-70-41-9-3-1-7-39(34)41)55(90)80-49(21-33-13-15-38(86)16-14-33)61(96)84-20-6-12-51(84)60(95)82-83-63(66)97)75-57(92)47(24-36-28-67-31-72-36)79-59(94)50(30-85)81-56(91)46(23-35-27-71-42-10-4-2-8-40(35)42)77-58(93)48(25-37-29-68-32-73-37)78-54(89)44-17-18-52(87)74-44/h1-4,7-10,13-16,26-29,31-32,36-37,43-51,70-71,85-86H,5-6,11-12,17-25,30H2,(H,74,87)(H,75,92)(H,76,88)(H,77,93)(H,78,89)(H,79,94)(H,80,90)(H,81,91)(H,82,95)(H4,64,65,69)(H3,66,83,97)/t36?,37?,43-,44+,45+,46+,47+,48+,49+,50+,51+/m1/s1

InChIKey

CSLXMGCDIICQMP-JZQSSKOYSA-N

Compound name

(2S)-N-[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2R)-5-carbamimidamido-1-[[(2S)-1-[[(2S)-1-[(2S)-2-[(carbamoylamino)carbamoyl]pyrrolidin-1-yl]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-1-oxopentan-2-yl]amino]-3-(4H-imidazol-4-yl)-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-3-(4H-imidazol-4-yl)-1-oxopropan-2-yl]-5-oxopyrrolidine-2-carboxamide

Related CIDs

• CID 129894398