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N-({[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-hydroxy-4-oxo-4H-chromen-7-yl]oxy}acetyl)-D-alanyl-N-(1-amino-6-methyl-1,3-dioxoheptan-4-yl)prolinamide

Catalog ID
STL565429
SMILES CC(CC(C(=O)CC(=O)N)NC(=O)C1CCCN1C(=O)[C@H](NC(=O)COc1cc(O)c2c(c1)occ(c2=O)c1ccc2c(c1)OCCO2)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 C35H40N4O11 MW 692.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H40N4O11/c1-18(2)11-23(25(40)15-30(36)42)38-34(45)24-5-4-8-39(24)35(46)19(3)37-31(43)17-49-21-13-26(41)32-29(14-21)50-16-22(33(32)44)20-6-7-27-28(12-20)48-10-9-47-27/h6-7,12-14,16,18-19,23-24,41H,4-5,8-11,15,17H2,1-3H3,(H2,36,42)(H,37,43)(H,38
InChIKey
MOIJAHWAZFJXSM-NNAHLOSHSA-N
Synonyms

44661483
CC(CC(C(=O)CC(=O)N)NC(=O)C1CCCN1C(=O)(C@H)(NC(=O)COc1cc(O)c2c(c1)occ(c2=O)c1ccc2c(c1)OCCO2)C)C
InChI=1SC35H40N4O11c118(2)1123(25(40)1530(36)42)3834(45)2454839(24)35(46)19(3)3731(43)1749211326(41)3229(1421)501622(33(32)44)20672728(1220)481094727h671214161819232441H458111517H213H3(H23642)(H3743)(H3845)t1923?24?m1s1
MFCD32651668
N(((3(23dihydro14benzodioxin6yl)5hydroxy4oxo4Hchromen7yl)oxy)acetyl)DalanylN(1amino6methyl13dioxoheptan4yl)prolinamide
N(1amino6methyl13dioxoheptan4yl)1((2R)2((2(3(23dihydro14benzodioxin6yl)5hydroxy4oxochromen7yl)oxyacetyl)amino)propanoyl)pyrrolidine2carboxamide
N(1amino6methyl13dioxoheptan4yl)1((R)2(2((3(23dihydrobenzo(b)(14)dioxin6yl)5hydroxy4oxo4Hchromen7yl)oxy)acetamido)propanoyl)pyrrolidine2carboxamide
ZINC000150484449
ZINC000150484461

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Available files

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