Z-Trp-OH

CAT: 0024-sc-224443ASize: 100 gDry Ice: NoHazardous: No

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CAT#:0024-sc-224443ASize:100 g

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CAS Number

7432-21-5

Chemical Information

benzyloxycarbonyl-L-tryptophan

receptor antagonist for peptides from gastrin family; RN given refers to (L)-isomer

CAS Number	7432-21-5
PubChem CID	101176
IUPAC Name	(2S)-3-(1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoic acid
Molecular Formula	C19H18N2O4
Molecular Weight	338.4
XLogP	2.3
Topological Polar Surface Area	91.4
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	7
Heavy Atom Count	25
Formal Charge	0
Complexity	464

SMILES

C1=CC=C(C=C1)COC(=O)N[C@@H](CC2=CNC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C19H18N2O4/c22-18(23)17(10-14-11-20-16-9-5-4-8-15(14)16)21-19(24)25-12-13-6-2-1-3-7-13/h1-9,11,17,20H,10,12H2,(H,21,24)(H,22,23)/t17-/m0/s1

InChIKey

AHYFYYVVAXRMKB-KRWDZBQOSA-N

Chemical Structure

2D Structure

CAS: 7432-21-5

CID: 101176

Formula: C19H18N2O4

MW: 338.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	338.4
XLogP3	2.3
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	7
Exact Mass	338.12665706
Monoisotopic Mass	338.12665706
Topological Polar Surface Area	91.4 Å²
Heavy Atom Count	25
Formal Charge	0
Complexity	464
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes