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-(4-hydroxyphenyl)-L-valinamide
Catalog ID
STL546346
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)N[C@H](C(=O)Nc2ccc(cc2)O)C(C)C)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 C32H37N3O7 MW 575.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H37N3O7/c1-17(2)29(32(39)34-20-8-10-21(37)11-9-20)35-25-14-12-22-23(16-26(25)38)24(33-18(3)36)13-7-19-15-27(40-4)30(41-5)31(42-6)28(19)22/h8-12,14-17,24,29,37H,7,13H2,1-6H3,(H,33,36)(H,34,39)(H,35,38)/t24-,29-/m0/s1InChIKey
LRGILLGHJCFTIM-OUTSHDOLSA-NSynonyms
(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(4hydroxyphenyl)3methylbutanamide
(S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(4hydroxyphenyl)3methylbutanamide
110207962
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)N(C@H)(C(=O)Nc2ccc(cc2)O)C(C)C)NC(=O)C)cc(c1OC)OC
InChI=1SC32H37N3O7c117(2)29(32(39)342081021(37)11920)352514122223(1626(25)38)24(3318(3)36)137191527(404)30(415)31(426)28(19)22h8121417242937H713H216H3(H3336)(H3439)(H3538)t2429m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(4hydroxyphenyl)Lvalinamide
ZINC000253409340
ZINC253409340
Check stock
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Check stock on Vitas-MAvailable files
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