Vitas-M small molecule compound

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

Catalog ID
STL539980
SMILES COCCCNC(=O)CCCNc1ccc2c(cc1=O)[C@H](CCc1c2c(OC)c(c(c1)OC)OC)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 C29H39N3O7 MW 541.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H39N3O7/c1-18(33)32-22-11-9-19-16-25(37-3)28(38-4)29(39-5)27(19)20-10-12-23(24(34)17-21(20)22)30-13-6-8-26(35)31-14-7-15-36-2/h10,12,16-17,22H,6-9,11,13-15H2,1-5H3,(H,30,34)(H,31,35)(H,32,33)/t22-/m0/s1
InChIKey
WJRKAJBCUOACIZ-QFIPXVFZSA-N
Synonyms
1574392-64-5
(S)4((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(3methoxypropyl)butanamide
1574392645
4(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(3methoxypropyl)butanamide
4(((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(3methoxypropyl)butanamide
75491369
COCCCNC(=O)CCCNc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC29H39N3O7c118(33)3222119191625(373)28(384)29(395)27(19)20101223(24(34)1721(20)22)30136826(35)3114715362h1012161722H69111315H215H3(H3034)(H3135)(H3233)t22m0s1
ZINC000108448475
ZINC108448475

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Available files

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