Vitas-M small molecule compound
(2R)-[(N-{[1-(tert-butoxycarbonyl)-4-phenylpiperidin-4-yl]carbonyl}-D-alanyl)amino](phenyl)ethanoic acid
Catalog ID
STL529980
SMILES C[C@H](C(=O)N[C@H](c1ccccc1)C(=O)O)NC(=O)C1(CCN(CC1)C(=O)OC(C)(C)C)c1ccccc1
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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 C28H35N3O6 MW 509.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H35N3O6/c1-19(23(32)30-22(24(33)34)20-11-7-5-8-12-20)29-25(35)28(21-13-9-6-10-14-21)15-17-31(18-16-28)26(36)37-27(2,3)4/h5-14,19,22H,15-18H2,1-4H3,(H,29,35)(H,30,32)(H,33,34)/t19-,22-/m1/s1InChIKey
NFDIIJYBVFLLLH-DENIHFKCSA-NSynonyms
956992-67-9(2~(R))2(((2~(R))2((1((2methylpropan2yl)oxycarbonyl)4phenylpiperidine4carbonyl)amino)propanoyl)amino)2phenylaceticacid
(2R)((N((1(tertbutoxycarbonyl)4phenylpiperidin4yl)carbonyl)Dalanyl)amino)(phenyl)ethanoicacid
(R)2((S)2(1(tertbutoxycarbonyl)4phenylpiperidine4carboxamido)propanamido)2phenylaceticacid
16405028
956992679
C(C@@H)(C(=O)N(C@H)(c1ccccc1)C(=O)O)NC(=O)C1(CCN(CC1)C(=O)OC(C)(C)C)c1ccccc1
InChI=1SC28H35N3O6c119(23(32)3022(24(33)34)20117581220)2925(35)28(211396101421)151731(181628)26(36)3727(23)4h5141922H1518H214H3(H2935)(H3032)(H3334)t1922m1s1
ZINC000008791203
ZINC8791203
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