Gpr1ntp-(8-20)

Structural Information

Molecular Formula

C₇₈H₁₀₂N₁₄O₂₈

SMILES

CC(C)C[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CC3=CC=C(C=C3)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC4=CC=C(C=C4)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O)N

InChI

InChI=1S/C78H102N14O28/c1-39(2)29-47(79)66(107)84-52(31-41-11-7-5-8-12-41)71(112)82-48(23-26-61(97)98)67(108)81-49(24-27-62(99)100)68(109)86-53(32-42-13-9-6-10-14-42)72(113)83-50(25-28-63(101)102)69(110)89-56(35-60(80)96)75(116)87-55(34-44-17-21-46(95)22-18-44)74(115)92-59(38-93)77(118)88-54(33-43-15-19-45(94)20-16-43)73(114)90-57(36-64(103)104)76(117)85-51(30-40(3)4)70(111)91-58(78(119)120)37-65(105)106/h5-22,39-40,47-59,93-95H,23-38,79H2,1-4H3,(H2,80,96)(H,81,108)(H,82,112)(H,83,113)(H,84,107)(H,85,117)(H,86,109)(H,87,116)(H,88,118)(H,89,110)(H,90,114)(H,91,111)(H,92,115)(H,97,98)(H,99,100)(H,101,102)(H,103,104)(H,105,106)(H,119,120)/t47-,48-,49-,50-,51-,52-,53-,54-,55-,56-,57-,58-,59-/m0/s1

InChIKey

PGHNNCIZZOUNEO-JWKNPDOPSA-N

Compound name

(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-4-methylpentanoyl]amino]-3-phenylpropanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-3-phenylpropanoyl]amino]-4-carboxybutanoyl]amino]-4-oxobutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxypropanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-carboxypropanoyl]amino]-4-methylpentanoyl]amino]butanedioic acid

Related CIDs

• CID 16134125