Vitas-M small molecule compound

7-methyl-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-9-yl N-[(benzyloxy)carbonyl]-L-valinate

Catalog ID
STL462530
SMILES O=C(N[C@H](C(=O)Oc1cc(C)cc2c1c1CCCc1c(=O)o2)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 C26H27NO6 MW 449.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27NO6/c1-15(2)23(27-26(30)31-14-17-8-5-4-6-9-17)25(29)33-21-13-16(3)12-20-22(21)18-10-7-11-19(18)24(28)32-20/h4-6,8-9,12-13,15,23H,7,10-11,14H2,1-3H3,(H,27,30)/t23-/m0/s1
InChIKey
PSGAMIJTYDZXDY-QHCPKHFHSA-N
Synonyms
956049-22-2
(7METHYL4OXO23DIHYDRO1HCYCLOPENTA(C)CHROMEN9YL)(2S)3METHYL2(PHENYLMETHOXYCARBONYLAMINO)BUTANOATE
(S)7methyl4oxo1234tetrahydrocyclopenta(c)chromen9yl2(((benzyloxy)carbonyl)amino)3methylbutanoate
7methyl4oxo1234tetrahydrocyclopenta(c)chromen9ylN((benzyloxy)carbonyl)Lvalinate
956049222
CC1=CC2=C(C3=C(CCC3)C(=O)O2)C(=C1)OC(=O)C(C(C)C)NC(=O)OCC4=CC=CC=C4
InChI=1SC26H27NO6c115(2)23(2726(30)3114178546917)25(29)33211316(3)122022(21)181071119(18)24(28)3220h468912131523H7101114H213H3(H2730)t23m0s1
O=C(N(C@H)(C(=O)Oc1cc(C)cc2c1c1CCCc1c(=O)o2)C(C)C)OCc1ccccc1
ZINC000002094372
ZINC02094372
ZINC2094372

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Available files

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