Vitas-M small molecule compound

N-{[(6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy]acetyl}glycyl-L-phenylalanine

Catalog ID
STL461064
SMILES O=C(COc1ccc2c(c1)oc(=O)c1c2CCCC1)NCC(=O)N[C@H](C(=O)O)Cc1ccccc1

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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 C26H26N2O7 MW 478.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N2O7/c29-23(28-21(25(31)32)12-16-6-2-1-3-7-16)14-27-24(30)15-34-17-10-11-19-18-8-4-5-9-20(18)26(33)35-22(19)13-17/h1-3,6-7,10-11,13,21H,4-5,8-9,12,14-15H2,(H,27,30)(H,28,29)(H,31,32)/t21-/m0/s1
InChIKey
KGPCJMLPJOTTBS-NRFANRHFSA-N
Synonyms

(2S)2((2((2((6oxo78910tetrahydrobenzo(c)chromen3yl)oxy)acetyl)amino)acetyl)amino)3phenylpropanoicacid
(R)2(2(2((6oxo78910tetrahydro6Hbenzo(c)chromen3yl)oxy)acetamido)acetamido)3phenylpropanoicacid
C1CCC2=C(C1)C3=C(C=C(C=C3)OCC(=O)NCC(=O)NC(CC4=CC=CC=C4)C(=O)O)OC2=O
InChI=1SC26H26N2O7c2923(2821(25(31)32)12166213716)142724(30)15341710111918845920(18)26(33)3522(19)1317h136710111321H4589121415H2(H2730)(H2829)(H3132)t21m0s1
N(((6oxo78910tetrahydro6Hbenzo(c)chromen3yl)oxy)acetyl)glycylLphenylalanine
O=C(COc1ccc2c(c1)oc(=O)c1c2CCCC1)NCC(=O)N(C@@H)(C(=O)O)Cc1ccccc1
O=C(COc1ccc2c(c1)oc(=O)c1c2CCCC1)NCC(=O)N(C@H)(C(=O)O)Cc1ccccc1
ZINC000011866878
ZINC11866878

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Available files

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