(3S)-3-[[(2S,3R)-2-amino-3-hydroxy-butanoyl]amino]-3-[[(1S)-2-carbamoyl-1-[[(1S)-1-[[(1S,2R)-1-carboxy-2-hydroxy-propyl]carbamoyl]-2-(4-hydroxyphenyl)ethyl]carbamoyl]ethyl]carbamoyl]propanoic acid
Molecular Formula:
C25H36N6O12
InChI: InChI=1/C25H36N6O12/c1-10(32)19(27)24(41)30-16(9-18(36)37)22(39)29-15(8-17(26)35)21(38)28-14(7-12-3-5-13(34)6-4-12)23(40)31-20(11(2)33)25(42)43/h3-6,10-11,14-16,19-20,32-34H,7-9,27H2,1-2H3,(H2,26,35)(H,28,38)(H,29,39)(H,30,41)(H,31,40)(H,36,37)(H,42,43)/t10-,11-,14+,15+,16+,19+,20+/m1/s1/f/h28-31,36,42H,26H2
InChIKey: InChIKey=HZUXWTFTXZRVQJ-JUCNAZPIDH
SMILES: CC(C(C(=O)NC(CC(=O)O)C(=O)NC(CC(=O)N)C(=O)NC(CC1=CC=C(C=C1)O)C(=O)NC(C(C)O)C(=O)O)N)O
Names:
(3S)-3-[[(2S,3R)-2-amino-3-hydroxy-butanoyl]amino]-3-[[(1S)-2-carbamoyl-1-[[(1S)-1-[[(1S,2R)-1-carboxy-2-hydroxy-propyl]carbamoyl]-2-(4-hydroxyphenyl)ethyl]carbamoyl]ethyl]carbamoyl]propanoic acid
Registries:
PubChem CID 129882
PubChem ID 10242463
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