Vitas-M small molecule compound
2-chloro-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl N-[(benzyloxy)carbonyl]-L-valinate
Catalog ID
STK716834
SMILES O=C(N[C@H](C(=O)Oc1cc2oc(=O)c3c(c2cc1Cl)CCCC3)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 C26H26ClNO6 MW 483.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26ClNO6/c1-15(2)23(28-26(31)32-14-16-8-4-3-5-9-16)25(30)34-22-13-21-19(12-20(22)27)17-10-6-7-11-18(17)24(29)33-21/h3-5,8-9,12-13,15,23H,6-7,10-11,14H2,1-2H3,(H,28,31)/t23-/m0/s1InChIKey
ABYJSDFEGVEKJD-QHCPKHFHSA-NSynonyms
1013792-61-4(2chloro6oxo78910tetrahydrobenzo(c)chromen3yl)(2S)3methyl2(phenylmethoxycarbonylamino)butanoate
(S)2chloro6oxo78910tetrahydro6Hbenzo(c)chromen3yl2(((benzyloxy)carbonyl)amino)3methylbutanoate
1013792614
2chloro6oxo78910tetrahydro6Hbenzo(c)chromen3ylN((benzyloxy)carbonyl)Lvalinate
CC(C)C(C(=O)OC1=C(C=C2C3=C(CCCC3)C(=O)OC2=C1)Cl)NC(=O)OCC4=CC=CC=C4
InChI=1SC26H26ClNO6c115(2)23(2826(31)3214168435916)25(30)3422132119(1220(22)27)1710671118(17)24(29)3321h358912131523H67101114H212H3(H2831)t23m0s1
MFCD04019309
O=C(N(C@H)(C(=O)Oc1cc2oc(=O)c3c(c2cc1Cl)CCCC3)C(C)C)OCc1ccccc1
ZINC000011866730
ZINC11866730
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