Vitas-M small molecule compound

1-benzyl 2-(8-methoxy-4-methyl-6-oxo-6H-benzo[c]chromen-3-yl) (2S)-pyrrolidine-1,2-dicarboxylate

Catalog ID
STL462389
SMILES COc1ccc2c(c1)c(=O)oc1c2ccc(c1C)OC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1

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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 C28H25NO7 MW 487.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25NO7/c1-17-24(13-12-21-20-11-10-19(33-2)15-22(20)26(30)36-25(17)21)35-27(31)23-9-6-14-29(23)28(32)34-16-18-7-4-3-5-8-18/h3-5,7-8,10-13,15,23H,6,9,14,16H2,1-2H3/t23-/m0/s1
InChIKey
ZBPKEKDZDFJPGD-QHCPKHFHSA-N
Synonyms

(R)1benzyl2(8methoxy4methyl6oxo6Hbenzo(c)chromen3yl)pyrrolidine12dicarboxylate
1benzyl2(8methoxy4methyl6oxo6Hbenzo(c)chromen3yl)(2S)pyrrolidine12dicarboxylate
1Obenzyl2O(8methoxy4methyl6oxobenzo(c)chromen3yl)(2S)pyrrolidine12dicarboxylate
CC1=C(C=CC2=C1OC(=O)C3=C2C=CC(=C3)OC)OC(=O)C4CCCN4C(=O)OCC5=CC=CC=C5
COc1ccc2c(c1)c(=O)oc1c2ccc(c1C)OC(=O)(C@@H)1CCCN1C(=O)OCc1ccccc1
COc1ccc2c(c1)c(=O)oc1c2ccc(c1C)OC(=O)(C@H)1CCCN1C(=O)OCc1ccccc1
InChI=1SC28H25NO7c11724(13122120111019(332)1522(20)26(30)3625(17)21)3527(31)23961429(23)28(32)3416187435818h357810131523H691416H212H3t23m0s1
MFCD06492595
ZINC000011867485
ZINC11867485

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Available files

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