Vitas-M small molecule compound

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

Catalog ID
STL460096
SMILES O=C(N[C@H](C(=O)Oc1ccc2c(c1)oc(c(c2=O)Oc1ccccc1)C)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 C29H27NO7 MW 501.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27NO7/c1-18(2)25(30-29(33)34-17-20-10-6-4-7-11-20)28(32)37-22-14-15-23-24(16-22)35-19(3)27(26(23)31)36-21-12-8-5-9-13-21/h4-16,18,25H,17H2,1-3H3,(H,30,33)/t25-/m0/s1
InChIKey
UMJNJVCMQYDKTM-VWLOTQADSA-N
Synonyms

(2METHYL4OXO3PHENOXYCHROMEN7YL)(2S)3METHYL2(PHENYLMETHOXYCARBONYLAMINO)BUTANOATE
(R)2methyl4oxo3phenoxy4Hchromen7yl2(((benzyloxy)carbonyl)amino)3methylbutanoate
2methyl4oxo3phenoxy4Hchromen7ylN((benzyloxy)carbonyl)Lvalinate
CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C(C(C)C)NC(=O)OCC3=CC=CC=C3)OC4=CC=CC=C4
InChI=1SC29H27NO7c118(2)25(3029(33)341720106471120)28(32)372214152324(1622)3519(3)27(26(23)31)3621128591321h4161825H17H213H3(H3033)t25m0s1
MFCD01544318
O=C(N(C@@H)(C(=O)Oc1ccc2c(c1)oc(c(c2=O)Oc1ccccc1)C)C(C)C)OCc1ccccc1
O=C(N(C@H)(C(=O)Oc1ccc2c(c1)oc(c(c2=O)Oc1ccccc1)C)C(C)C)OCc1ccccc1
ZINC000001108150
ZINC01108150
ZINC1108150

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Available files

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