Vitas-M small molecule compound

6-{[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]amino}-N-cyclopropylhexanamide

Catalog ID
STL540220
SMILES COc1cc2CC[C@@H](c3c(c2c(c1OC)OC)ccc(c(=O)c3)NCCCCCC(=O)NC1CC1)NC(=O)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 C30H39N3O6 MW 537.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H39N3O6/c1-18(34)32-23-13-9-19-16-26(37-2)29(38-3)30(39-4)28(19)21-12-14-24(25(35)17-22(21)23)31-15-7-5-6-8-27(36)33-20-10-11-20/h12,14,16-17,20,23H,5-11,13,15H2,1-4H3,(H,31,35)(H,32,34)(H,33,36)/t23-/m0/s1
InChIKey
AHGOHUOCSVAILP-QHCPKHFHSA-N
Synonyms
1574377-11-9
(S)6((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)Ncyclopropylhexanamide
1574377119
6(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)cyclopropylhexanamide
6(((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)Ncyclopropylhexanamide
75491095
COc1cc2CC(C@@H)(c3c(c2c(c1OC)OC)ccc(c(=O)c3)NCCCCCC(=O)NC1CC1)NC(=O)C
InChI=1SC30H39N3O6c118(34)3223139191626(372)29(383)30(394)28(19)21121424(25(35)1722(21)23)3115756827(36)3320101120h121416172023H5111315H214H3(H3135)(H3234)(H3336)t23m0s1
ZINC000096220991
ZINC96220991

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Available files

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