(3S)-2-[(2S)-2-[[(2S)-2-[[(3S)-2-[(2S)-2-[[(2S)-2-amino-3-phenyl-propanoyl]amino]-3-phenyl-propanoyl]3,4-dihydro-1H-isoquinoline-3-carbonyl]amino]-3-phenyl-propanoyl]amino]-3-phenyl-propanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
Molecular Formula:
C56H56N6O7
InChI: InChI=1/C56H56N6O7/c57-45(29-37-17-5-1-6-18-37)51(63)59-47(31-39-21-9-3-10-22-39)54(66)61-35-43-27-15-13-25-41(43)33-49(61)53(65)58-46(30-38-19-7-2-8-20-38)52(64)60-48(32-40-23-11-4-12-24-40)55(67)62-36-44-28-16-14-26-42(44)34-50(62)56(68)69/h1-28,45-50H,29-36,57H2,(H,58,65)(H,59,63)(H,60,64)(H,68,69)/t45-,46-,47-,48-,49-,50-/m0/s1/f/h58-60,68H
InChIKey: InChIKey=CDDDEILPTTXRJT-AQVGPELMDM
SMILES: C1C(N(CC2=CC=CC=C21)C(=O)C(CC3=CC=CC=C3)NC(=O)C(CC4=CC=CC=C4)N)C(=O)NC(CC5=CC=CC=C5)C(=O)NC(CC6=CC=CC=C6)C(=O)N7CC8=CC=CC=C8CC7C(=O)O
Names:
(3S)-2-[(2S)-2-[[(2S)-2-[[(3S)-2-[(2S)-2-[[(2S)-2-amino-3-phenyl-propanoyl]amino]-3-phenyl-propanoyl]3,4-dihydro-1H-isoquinoline-3-carbonyl]amino]-3-phenyl-propanoyl]amino]-3-phenyl-propanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
Registries:
PubChem CID 10328459
PubChem ID 15337969
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