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-(2-methoxyethyl)butanamide

Catalog ID
STL542429
SMILES COCCNC(=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 C28H37N3O7 MW 527.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H37N3O7/c1-17(32)31-21-10-8-18-15-24(36-3)27(37-4)28(38-5)26(18)19-9-11-22(23(33)16-20(19)21)29-12-6-7-25(34)30-13-14-35-2/h9,11,15-16,21H,6-8,10,12-14H2,1-5H3,(H,29,33)(H,30,34)(H,31,32)/t21-/m0/s1
InChIKey
ATRDFZWUXCJSPA-NRFANRHFSA-N
Synonyms
1574339-07-3
(S)4((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(2methoxyethyl)butanamide
1574339073
4(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(2methoxyethyl)butanamide
4(((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(2methoxyethyl)butanamide
75492034
COCCNC(=O)CCCNc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC28H37N3O7c117(32)3121108181524(363)27(374)28(385)26(18)1991122(23(33)1620(19)21)29126725(34)301314352h911151621H68101214H215H3(H2933)(H3034)(H3132)t21m0s1
ZINC000096222178
ZINC96222178

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Available files

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