Vitas-M small molecule compound

N-[(4-hydroxyphthalazin-1-yl)acetyl]tryptophan

Catalog ID
STK618873
SMILES O=C(Cc1nnc(c2c1cccc2)O)NC(C(=O)O)Cc1c[nH]c2c1cccc2

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C21H18N4O4 MW 390.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N4O4/c26-19(10-17-14-6-1-2-7-15(14)20(27)25-24-17)23-18(21(28)29)9-12-11-22-16-8-4-3-5-13(12)16/h1-8,11,18,22H,9-10H2,(H,23,26)(H,25,27)(H,28,29)
InChIKey
PTKTXVAQDHJVJH-UHFFFAOYSA-N
Synonyms

3(1Hindol3yl)2((2(4oxo3Hphthalazin1yl)acetyl)amino)propanoicacid
C1=CC=C2C(=C1)C(=NNC2=O)CC(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)O
InChI=1SC21H18N4O4c2619(101714612715(14)20(27)252417)2318(21(28)29)912112216843513(12)16h18111822H910H2(H2326)(H2527)(H2829)
MFCD09788823
N((4hydroxyphthalazin1yl)acetyl)tryptophan
O=C(Cc1nnc(c2c1cccc2)O)NC(C(=O)O)Cc1c(nH)c2c1cccc2
ZINC000009575342
ZINC000013548542

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.