Vitas-M small molecule compound

(2S)-2-({[(2,2-dimethyl-6-oxo-3,4,6,7,8,9-hexahydro-2H-cyclopenta[c]pyrano[2,3-h]chromen-10-yl)oxy]acetyl}amino)-N-(2-hydroxyethyl)-2-phenylethanamide

Catalog ID
STK605166
SMILES OCCNC(=O)[C@H](c1ccccc1)NC(=O)COc1cc2OC(C)(C)CCc2c2c1c1CCCc1c(=O)o2

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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 C29H32N2O7 MW 520.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32N2O7/c1-29(2)12-11-20-21(38-29)15-22(24-18-9-6-10-19(18)28(35)37-26(20)24)36-16-23(33)31-25(27(34)30-13-14-32)17-7-4-3-5-8-17/h3-5,7-8,15,25,32H,6,9-14,16H2,1-2H3,(H,30,34)(H,31,33)/t25-/m0/s1
InChIKey
ZOEBURWWWALRJD-VWLOTQADSA-N
Synonyms
1014084-02-6
(2S)2((((22dimethyl6oxo346789hexahydro2Hcyclopenta(c)pyrano(23h)chromen10yl)oxy)acetyl)amino)N(2hydroxyethyl)2phenylethanamide
(S)2(2((22dimethyl6oxo346789hexahydro2Hcyclopenta(c)pyrano(23h)chromen10yl)oxy)acetamido)N(2hydroxyethyl)2phenylacetamide
1014084026
CC1(CCC2=C3C(=C(C=C2O1)OCC(=O)NC(C4=CC=CC=C4)C(=O)NCCO)C5=C(CCC5)C(=O)O3)C
InChI=1SC29H32N2O7c129(2)12112021(3829)1522(2418961019(18)28(35)3726(20)24)361623(33)3125(27(34)30131432)177435817h3578152532H691416H212H3(H3034)(H3133)t25m0s1
MFCD08290217
OCCNC(=O)(C@H)(c1ccccc1)NC(=O)COc1cc2OC(C)(C)CCc2c2c1c1CCCc1c(=O)o2
ZINC000009410475
ZINC09410475
ZINC9410475

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.