Vitas-M small molecule compound
1-hydroxy-5-methyl-9-oxo-9H-xanthen-3-yl N-(tert-butoxycarbonyl)-D-alaninate
Catalog ID
STK594688
SMILES O=C(OC(C)(C)C)N[C@@H](C(=O)Oc1cc(O)c2c(c1)oc1c(c2=O)cccc1C)C
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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 C22H23NO7 MW 413.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23NO7/c1-11-7-6-8-14-18(25)17-15(24)9-13(10-16(17)29-19(11)14)28-20(26)12(2)23-21(27)30-22(3,4)5/h6-10,12,24H,1-5H3,(H,23,27)/t12-/m1/s1InChIKey
ZKTDWPOVMYLALE-GFCCVEGCSA-NSynonyms
1212345-09-9(1HYDROXY5METHYL9OXOXANTHEN3YL)(2R)2((2METHYLPROPAN2YL)OXYCARBONYLAMINO)PROPANOATE
(R)1hydroxy5methyl9oxo9Hxanthen3yl2((tertbutoxycarbonyl)amino)propanoate
1212345099
1hydroxy5methyl9oxo9Hxanthen3ylN(tertbutoxycarbonyl)Dalaninate
CC1=CC=CC2=C1OC3=CC(=CC(=C3C2=O)O)OC(=O)C(C)NC(=O)OC(C)(C)C
InChI=1SC22H23NO7c1117681418(25)1715(24)913(1016(17)2919(11)14)2820(26)12(2)2321(27)3022(34)5h6101224H15H3(H2327)t12m1s1
MFCD08284463
O=C(OC(C)(C)C)N(C@@H)(C(=O)Oc1cc(O)c2c(c1)oc1c(c2=O)cccc1C)C
ZINC000005425350
ZINC05425350
ZINC5425350
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