Vitas-M small molecule compound

5-benzyl 1-(5-hydroxy-4-oxo-2-phenyl-4H-chromen-7-yl) N-[(benzyloxy)carbonyl]-L-glutamate

Catalog ID
STL460112
SMILES O=C(CC[C@@H](C(=O)Oc1cc(O)c2c(c1)oc(cc2=O)c1ccccc1)NC(=O)OCc1ccccc1)OCc1ccccc1

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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 C35H29NO9 MW 607.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H29NO9/c37-28-18-26(19-31-33(28)29(38)20-30(45-31)25-14-8-3-9-15-25)44-34(40)27(36-35(41)43-22-24-12-6-2-7-13-24)16-17-32(39)42-21-23-10-4-1-5-11-23/h1-15,18-20,27,37H,16-17,21-22H2,(H,36,41)/t27-/m0/s1
InChIKey
KFDDCKRXKGLNDA-MHZLTWQESA-N
Synonyms
308105-86-4
(S)5benzyl1(5hydroxy4oxo2phenyl4Hchromen7yl)2(((benzyloxy)carbonyl)amino)pentanedioate
308105864
5benzyl1(5hydroxy4oxo2phenyl4Hchromen7yl)N((benzyloxy)carbonyl)Lglutamate
5Obenzyl1O(5hydroxy4oxo2phenylchromen7yl)(2S)2(phenylmethoxycarbonylamino)pentanedioate
C1=CC=C(C=C1)COC(=O)CCC(C(=O)OC2=CC(=C3C(=C2)OC(=CC3=O)C4=CC=CC=C4)O)NC(=O)OCC5=CC=CC=C5
InChI=1SC35H29NO9c37281826(193133(28)29(38)2030(4531)25148391525)4434(40)27(3635(41)432224126271324)161732(39)422123104151123h11518202737H16172122H2(H3641)t27m0s1
MFCD02056585
O=C(CC(C@@H)(C(=O)Oc1cc(O)c2c(c1)oc(cc2=O)c1ccccc1)NC(=O)OCc1ccccc1)OCc1ccccc1
ZINC000070664535
ZINC70664535

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Available files

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