Vitas-M small molecule compound
3-benzyl-4,8-dimethyl-2-oxo-2H-chromen-7-yl N-(tert-butoxycarbonyl)-L-isoleucinate
Catalog ID
STL462424
SMILES CC[C@H]([C@@H](C(=O)Oc1ccc2c(c1C)oc(=O)c(c2C)Cc1ccccc1)NC(=O)OC(C)(C)C)C
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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 C29H35NO6 MW 493.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H35NO6/c1-8-17(2)24(30-28(33)36-29(5,6)7)27(32)34-23-15-14-21-18(3)22(16-20-12-10-9-11-13-20)26(31)35-25(21)19(23)4/h9-15,17,24H,8,16H2,1-7H3,(H,30,33)/t17-,24+/m1/s1InChIKey
LTJQMRYNQCFUKO-OSPHWJPCSA-NSynonyms
956325-72-7(2S3R)3benzyl48dimethyl2oxo2Hchromen7yl2((tertbutoxycarbonyl)amino)3methylpentanoate
(3BENZYL48DIMETHYL2OXOCHROMEN7YL)(2S3R)3METHYL2((2METHYLPROPAN2YL)OXYCARBONYLAMINO)PENTANOATE
3benzyl48dimethyl2oxo2Hchromen7ylN(tertbutoxycarbonyl)Lisoleucinate
956325727
CC(C@H)((C@@H)(C(=O)Oc1ccc2c(c1C)oc(=O)c(c2C)Cc1ccccc1)NC(=O)OC(C)(C)C)C
CCC(C)C(C(=O)OC1=C(C2=C(C=C1)C(=C(C(=O)O2)CC3=CC=CC=C3)C)C)NC(=O)OC(C)(C)C
InChI=1SC29H35NO6c1817(2)24(3028(33)3629(56)7)27(32)342315142118(3)22(162012109111320)26(31)3525(21)19(23)4h9151724H816H217H3(H3033)t1724+m1s1
MFCD10567537
ZINC000002148470
ZINC02148470
ZINC2148470
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