Vitas-M small molecule compound
(E)-N~2~-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-[5-(methoxymethyl)-1,3,4-thiadiazol-2(3H)-ylidene]-L-valinamide
Catalog ID
STL544185
SMILES COCc1n[nH]/c(=N\C(=O)[C@H](C(C)C)Nc2ccc3c(cc2=O)[C@H](CCc2c3c(OC)c(c(c2)OC)OC)NC(=O)C)/s1
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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 C30H37N5O7S MW 611.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H37N5O7S/c1-15(2)26(29(38)33-30-35-34-24(43-30)14-39-4)32-21-11-9-18-19(13-22(21)37)20(31-16(3)36)10-8-17-12-23(40-5)27(41-6)28(42-7)25(17)18/h9,11-13,15,20,26H,8,10,14H2,1-7H3,(H,31,36)(H,32,37)(H,33,35,38)/t20-,26-/m0/s1InChIKey
HHSOSLBNTSTUPQ-FNZWTVRRSA-NSynonyms
1574376-79-6(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(5(methoxymethyl)134thiadiazol2yl)3methylbutanamide
(E)N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(5(methoxymethyl)134thiadiazol2(3H)ylidene)Lvalinamide
1574376796
75491789
InChI=1SC30H37N5O7Sc115(2)26(29(38)3330353424(4330)14394)32211191819(1322(21)37)20(3116(3)36)108171223(405)27(416)28(427)25(17)18h91113152026H81014H217H3(H3136)(H3237)(H333538)t2026m0s1
ZINC000108449545
ZINC108449545
Check stock
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