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2-(2-{[(benzyloxy)carbonyl]amino}-3-(1H-indol-3-yl)propanamido)acetic acid

HCID 333316
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Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
17388-70-4
Standard SMILES
O=C(O)CNC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1
InChIKey
CKMNNKBYQJXRAB-UHFFFAOYSA-N
Molecular formula
C21H21N3O5
Average molar mass
395.4 g/mol
Monoisotopic mass
395.14812078

Names & identifiers

Preferred name
2-(2-{[(benzyloxy)carbonyl]amino}-3-(1H-indol-3-yl)propanamido)acetic acid
IUPAC
2-[[3-(1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoyl]amino]acetic acid
English name
Z-TRP-GLY-OH
Molecular formula
C21H21N3O5
Molecular weight
395.41

Names & synonyms

17388-70-4Z-TRP-GLY-OH2-(2-{[(benzyloxy)carbonyl]amino}-3-(1H-indol-3-yl)propanamido)acetic acid2-[[3-(1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoyl]amino]acetic acid(S)-2-(2-(((Benzyloxy)carbonyl)amino)-3-(1H-indol-3-yl)propanamido)acetic acidNSC333734DTXSID103186632-[(2S)-2-{[(benzyloxy)carbonyl]amino}-3-(1H-indol-3-yl)propanamido]acetic acidAKOS024432391NSC-333734N-[(Benzyloxy)carbonyl]tryptophylglycineZ-Trp-Gly-OH (C-2700.0001)
Show more names
Z-Trp-GlyZ-L-TRYPTOPHYL-GLYCINECARBOBENZYLOXY-L-TRYPTOPHYLGLYCINEGlycine, N-[(phenylmethoxy)carbonyl]-L-tryptophyl-
{[(2S)-2-{[(benzyloxy)carbonyl]amino}-3-(1H-indol-3-yl)propanoyl]amino}acetic acid

Database identifiers

CAS

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

Melting point
158 · 158-159 °C
Boiling point
773.1 · 773.1±60.0 °C(Predicted)
Density
1.358 · 1.358±0.06 g/cm3(Predicted)
storage temp.
-15 °C · -15°C
pka
3.41 · 3.41±0.10(Predicted)

Chemistry & industry

Suppliers10 total

杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
梯希爱(上海)化工贸易有限公司021-61109150 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
杭州专肽生物技术有限公司17342063383 · [email protected]
成都云希化工有限公司+86-17380623303 · [email protected]
南京肽业生物科技有限公司025-58361106-805 15951641583 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
吉尔生化(上海)有限公司21-61263452 13641803416 · [email protected]
Nextpeptide Inc+86-0571-81612335 +8613336028439 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
17388-70-4
PubChem CID
333316
DTXSID
DTXSID10318663