Vitas-M small molecule compound
3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-1-yl N-(tert-butoxycarbonyl)-L-phenylalaninate
Catalog ID
STL462534
SMILES O=C(OC(C)(C)C)N[C@H](C(=O)Oc1cc(C)cc2c1c1CCCCc1c(=O)o2)Cc1ccccc1
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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 C28H31NO6 MW 477.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31NO6/c1-17-14-22-24(19-12-8-9-13-20(19)25(30)33-22)23(15-17)34-26(31)21(16-18-10-6-5-7-11-18)29-27(32)35-28(2,3)4/h5-7,10-11,14-15,21H,8-9,12-13,16H2,1-4H3,(H,29,32)/t21-/m0/s1InChIKey
RCCQMPCQMGUQBC-NRFANRHFSA-NSynonyms
956044-37-4(3methyl6oxo78910tetrahydrobenzo(c)chromen1yl)(2S)2((2methylpropan2yl)oxycarbonylamino)3phenylpropanoate
(S)3methyl6oxo78910tetrahydro6Hbenzo(c)chromen1yl2((tertbutoxycarbonyl)amino)3phenylpropanoate
3methyl6oxo78910tetrahydro6Hbenzo(c)chromen1ylN(tertbutoxycarbonyl)Lphenylalaninate
956044374
CC1=CC2=C(C3=C(CCCC3)C(=O)O2)C(=C1)OC(=O)C(CC4=CC=CC=C4)NC(=O)OC(C)(C)C
InChI=1SC28H31NO6c117142224(1912891320(19)25(30)3322)23(1517)3426(31)21(1618106571118)2927(32)3528(23)4h571011141521H89121316H214H3(H2932)t21m0s1
O=C(OC(C)(C)C)N(C@H)(C(=O)Oc1cc(C)cc2c1c1CCCCc1c(=O)o2)Cc1ccccc1
ZINC000002148141
ZINC02148141
ZINC2148141
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