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4-{[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]amino}-N-[3-(2-methyl-2H-tetrazol-5-yl)phenyl]butanamide

Catalog ID
STL548382
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NCCCC(=O)Nc2cccc(c2)c2nnn(n2)C)NC(=O)C)cc(c1OC)OC

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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 C33H37N7O6 MW 627.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H37N7O6/c1-19(41)35-25-13-11-20-17-28(44-3)31(45-4)32(46-5)30(20)23-12-14-26(27(42)18-24(23)25)34-15-7-10-29(43)36-22-9-6-8-21(16-22)33-37-39-40(2)38-33/h6,8-9,12,14,16-18,25H,7,10-11,13,15H2,1-5H3,(H,34,42)(H,35,41)(H,36,43)/t25-/m0/s1
InChIKey
LUPYEDBRDJKHAF-VWLOTQADSA-N
Synonyms

(S)4((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(3(2methyl2Htetrazol5yl)phenyl)butanamide
110206601
4(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(3(2methyltetrazol5yl)phenyl)butanamide
4(((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(3(2methyl2Htetrazol5yl)phenyl)butanamide
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)NCCCC(=O)Nc2cccc(c2)c2nnn(n2)C)NC(=O)C)cc(c1OC)OC
InChI=1SC33H37N7O6c119(41)35251311201728(443)31(454)32(465)30(20)23121426(27(42)1824(23)25)341571029(43)362296821(1622)33373940(2)3833h6891214161825H710111315H215H3(H3442)(H3541)(H3643)t25m0s1
ZINC000253409423
ZINC253409423

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Available files

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