Vitas-M small molecule compound

4-oxo-3-phenoxy-4H-chromen-7-yl N-[(benzyloxy)carbonyl]-L-valinate

Catalog ID
STL460094
SMILES O=C(N[C@H](C(=O)Oc1ccc2c(c1)occ(c2=O)Oc1ccccc1)C(C)C)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 C28H25NO7 MW 487.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25NO7/c1-18(2)25(29-28(32)34-16-19-9-5-3-6-10-19)27(31)36-21-13-14-22-23(15-21)33-17-24(26(22)30)35-20-11-7-4-8-12-20/h3-15,17-18,25H,16H2,1-2H3,(H,29,32)/t25-/m0/s1
InChIKey
WWQOSNYHYBUXEN-VWLOTQADSA-N
Synonyms

(4OXO3PHENOXYCHROMEN7YL)(2S)3METHYL2(PHENYLMETHOXYCARBONYLAMINO)BUTANOATE
(R)4oxo3phenoxy4Hchromen7yl2(((benzyloxy)carbonyl)amino)3methylbutanoate
4oxo3phenoxy4Hchromen7ylN((benzyloxy)carbonyl)Lvalinate
CC(C)C(C(=O)OC1=CC2=C(C=C1)C(=O)C(=CO2)OC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4
InChI=1SC28H25NO7c118(2)25(2928(32)34161995361019)27(31)362113142223(1521)331724(26(22)30)3520117481220h315171825H16H212H3(H2932)t25m0s1
MFCD01543743
O=C(N(C@@H)(C(=O)Oc1ccc2c(c1)occ(c2=O)Oc1ccccc1)C(C)C)OCc1ccccc1
O=C(N(C@H)(C(=O)Oc1ccc2c(c1)occ(c2=O)Oc1ccccc1)C(C)C)OCc1ccccc1
ZINC000001108140
ZINC01108140
ZINC1108140

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Available files

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