Vitas-M small molecule compound
6-chloro-1-hydroxy-9-oxo-9H-xanthen-3-yl 4-{[(benzyloxy)carbonyl]amino}butanoate
Catalog ID
STK587572
SMILES O=C(Oc1cc(O)c2c(c1)oc1c(c2=O)ccc(c1)Cl)CCCNC(=O)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 C25H20ClNO7 MW 481.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20ClNO7/c26-16-8-9-18-20(11-16)34-21-13-17(12-19(28)23(21)24(18)30)33-22(29)7-4-10-27-25(31)32-14-15-5-2-1-3-6-15/h1-3,5-6,8-9,11-13,28H,4,7,10,14H2,(H,27,31)InChIKey
QQWFERMAPVUWNH-UHFFFAOYSA-NSynonyms
898917-85-6(6chloro1hydroxy9oxoxanthen3yl)4(phenylmethoxycarbonylamino)butanoate
6chloro1hydroxy9oxo9Hxanthen3yl4(((benzyloxy)carbonyl)amino)butanoate
898917856
C1=CC=C(C=C1)COC(=O)NCCCC(=O)OC2=CC(=C3C(=C2)OC4=C(C3=O)C=CC(=C4)Cl)O
InChI=1SC25H20ClNO7c2616891820(1116)34211317(1219(28)23(21)24(18)30)3322(29)74102725(31)3214155213615h135689111328H471014H2(H2731)
MFCD07639999
ZINC000009129302
ZINC09129302
ZINC9129302
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