Vitas-M small molecule compound

N~2~-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-(3,3-diphenylpropyl)glycinamide

Catalog ID
STL540215
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NCC(=O)NCCC(c2ccccc2)c2ccccc2)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 C38H41N3O6 MW 635.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H41N3O6/c1-24(42)41-31-17-15-27-21-34(45-2)37(46-3)38(47-4)36(27)29-16-18-32(33(43)22-30(29)31)40-23-35(44)39-20-19-28(25-11-7-5-8-12-25)26-13-9-6-10-14-26/h5-14,16,18,21-22,28,31H,15,17,19-20,23H2,1-4H3,(H,39,44)(H,40,43)(H,41,42)/t31-/m0/s1
InChIKey
WNZCAYFOKXPRQU-HKBQPEDESA-N
Synonyms
1574352-92-3
(S)2((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(33diphenylpropyl)acetamide
1574352923
2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(33diphenylpropyl)acetamide
75492240
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)NCC(=O)NCCC(c2ccccc2)c2ccccc2)NC(=O)C)cc(c1OC)OC
InChI=1SC38H41N3O6c124(42)41311715272134(452)37(463)38(474)36(27)29161832(33(43)2230(29)31)402335(44)39201928(25117581225)261396101426h514161821222831H1517192023H214H3(H3944)(H4043)(H4142)t31m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(33diphenylpropyl)glycinamide
ZINC000108450606
ZINC108450606

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Available files

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