Vitas-M small molecule compound
butyl (3S)-2'-amino-1-(2-ethoxy-2-oxoethyl)-2,5'-dioxo-1,2-dihydro-5'H-spiro[indole-3,4'-pyrano[3,2-c]chromene]-3'-carboxylate
Catalog ID
STL005924
SMILES CCCCOC(=O)C1=C(N)Oc2c([C@@]31C(=O)N(c1c3cccc1)CC(=O)OCC)c(=O)oc1c2cccc1
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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 C28H26N2O8 MW 518.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N2O8/c1-3-5-14-36-25(32)22-24(29)38-23-16-10-6-9-13-19(16)37-26(33)21(23)28(22)17-11-7-8-12-18(17)30(27(28)34)15-20(31)35-4-2/h6-13H,3-5,14-15,29H2,1-2H3/t28-/m0/s1InChIKey
QAPNDQRGGREXPI-NDEPHWFRSA-NSynonyms
1212191-57-5(S)butyl2amino1(2ethoxy2oxoethyl)25dioxo5Hspiro(indoline34pyrano(32c)chromene)3carboxylate
1212191575
butyl(3S)2amino1(2ethoxy2oxoethyl)25dioxo12dihydro5Hspiro(indole34pyrano(32c)chromene)3carboxylate
butyl(3S)2amino1(2ethoxy2oxoethyl)25dioxospiro(indole34pyrano(32c)chromene)3carboxylate
CCCCOC(=O)C1=C(N)Oc2c((C@@)31C(=O)N(c1c3cccc1)CC(=O)OCC)c(=O)oc1c2cccc1
CCCCOC(=O)C1=C(OC2=C(C13C4=CC=CC=C4N(C3=O)CC(=O)OCC)C(=O)OC5=CC=CC=C52)N
InChI=1SC28H26N2O8c135143625(32)2224(29)38231610691319(16)3726(33)21(23)28(22)1711781218(17)30(27(28)34)1520(31)3542h613H35141529H212H3t28m0s1
MFCD24857504
ZINC000009292168
ZINC09292168
ZINC9292168
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.