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3-(1H-indol-3-yl)-2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]propanoic acid

HCID 259608
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Basic information

CAS
3392-19-6
Standard SMILES
O=C(CNC(=O)OCc1ccccc1)NC(Cc1c[nH]c2ccccc12)C(=O)O
InChIKey
VFJWAPSFRKFYME-SFHVURJKSA-N
Molecular formula
C21H21N3O5
Average molar mass
395.4 g/mol
Monoisotopic mass
395.14812078

Names & identifiers

Preferred name
3-(1H-indol-3-yl)-2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]propanoic acid
IUPAC
3-(1H-indol-3-yl)-2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]propanoic acid
English name
Z-Gly-Trp-OH
Molecular formula
C21H21N3O5
Molecular weight
395.41

Names & synonyms

3-(1H-indol-3-yl)-2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]propanoic acid3392-19-6(2R)-2-[({[(benzyloxy)carbonyl]amino}acetyl)amino]-3-(1H-indol-3-yl)propanoic acidZ-Gly-Trp-OHNSC89647NSC-89647AKOS024432500Z-GLYCYL-L-TRYPTOPHANL-Tryptophan, N-[(phenylmethoxy)carbonyl]glycyl-N-benzyloxycarbonyl-1,5-pentanediaminehydrochloride

Database identifiers

CAS
3392-19-6
PubChem CID
259608

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
121 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
5
Rotatable bonds
9
Heavy atoms
29
Formal charge
0
Complexity
579

Physicochemical properties

storage temp.
-15 °C · -15°C

Related reactions

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Compound notes

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