Vitas-M small molecule compound

N-[3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g]chromen-3-yl)propanoyl]glycylglycyl-D-phenylalanine

Catalog ID
STL529698
SMILES O=C(CCc1c(=O)oc2c(c1C)cc1c(c2)oc2c1CCCC2)NCC(=O)NCC(=O)N[C@@H](C(=O)O)Cc1ccccc1

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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 C32H33N3O8 MW 587.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H33N3O8/c1-18-20(32(41)43-26-15-27-23(14-22(18)26)21-9-5-6-10-25(21)42-27)11-12-28(36)33-16-29(37)34-17-30(38)35-24(31(39)40)13-19-7-3-2-4-8-19/h2-4,7-8,14-15,24H,5-6,9-13,16-17H2,1H3,(H,33,36)(H,34,37)(H,35,38)(H,39,40)/t24-/m1/s1
InChIKey
NTWDLRAFPRKQQE-XMMPIXPASA-N
Synonyms
956994-54-0
(2~(R))2((2((2(3(4methyl2oxo6789tetrahydro(1)benzofuro(32g)chromen3yl)propanoylamino)acetyl)amino)acetyl)amino)3phenylpropanoicacid
(R)2(2(2(3(4methyl2oxo6789tetrahydro2Hbenzofuro(32g)chromen3yl)propanamido)acetamido)acetamido)3phenylpropanoicacid
16406315
956994540
InChI=1SC32H33N3O8c11820(32(41)4326152723(1422(18)26)219561025(21)4227)111228(36)331629(37)341730(38)3524(31(39)40)13197324819h2478141524H569131617H21H3(H3336)(H3437)(H3538)(H3940)t24m1s1
MFCD08002485
N(3(4methyl2oxo6789tetrahydro2H(1)benzofuro(32g)chromen3yl)propanoyl)glycylglycylDphenylalanine
O=C(CCc1c(=O)oc2c(c1C)cc1c(c2)oc2c1CCCC2)NCC(=O)NCC(=O)N(C@@H)(C(=O)O)Cc1ccccc1
ZINC000070707577
ZINC70707577

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Available files

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