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English
N-Fmoc-N'-benzyloxymethyl-L-histidine
chemical compound
Fmoc-His(3-Bom)-OH
N-Fluorenylmethoxycarbonyl-N'-benzyloxymethyl-L-histidine
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
497.19507096399997
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₂₉H₃₁N₃O₅
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canonical SMILES
O=C(NC(Cc1cncn1COCc1ccccc1)C(=O)O)OCC1c2ccccc2-c2ccccc21
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
C1=CC=C(C=C1)COCN2C=NC=C2C[C@@H](C(=O)O)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35
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Identifiers
InChI
InChI=1S/C29H27N3O5/c33-28(34)27(14-21-15-30-18-32(21)19-36-16-20-8-2-1-3-9-20)31-29(35)37-17-26-24-12-6-4-10-22(24)23-11-5-7-13-25(23)26/h1-13,15,18,26-27H,14,16-17,19H2,(H,31,35)(H,33,34)/t27-/m0/s1
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InChIKey
CJBFCDKGOPEUOF-MHZLTWQESA-N
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CAS Registry Number
84891-19-0
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PubChem CID
56777366
1 reference
matched by identifier from
InChIKey
InChIKey
CJBFCDKGOPEUOF-MHZLTWQESA-N
UniChem compound ID
7232835
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60718553
1 reference
matched by identifier from
InChIKey
InChIKey
CJBFCDKGOPEUOF-MHZLTWQESA-N
DSSTOX compound identifier
DTXCID20669299
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