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-[1-(2-methoxyethyl)-1H-indol-4-yl]-L-valinamide

Catalog ID
STL540392
SMILES COCCn1ccc2c1cccc2NC(=O)[C@H](C(C)C)Nc1ccc2c(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 C37H44N4O7 MW 656.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H44N4O7/c1-21(2)34(37(44)40-27-9-8-10-30-25(27)15-16-41(30)17-18-45-4)39-29-14-12-24-26(20-31(29)43)28(38-22(3)42)13-11-23-19-32(46-5)35(47-6)36(48-7)33(23)24/h8-10,12,14-16,19-21,28,34H,11,13,17-18H2,1-7H3,(H,38,42)(H,39,43)(H,40,44)/t28-,34-
InChIKey
RVPIPHUSZATPAQ-GVYVVWIYSA-N
Synonyms
1574379-46-6
(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(1(2methoxyethyl)indol4yl)3methylbutanamide
(S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(1(2methoxyethyl)1Hindol4yl)3methylbutanamide
1574379466
75491932
COCCn1ccc2c1cccc2NC(=O)(C@H)(C(C)C)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC37H44N4O7c121(2)34(37(44)402798103025(27)151641(30)1718454)392914122426(2031(29)43)28(3822(3)42)1311231932(465)35(476)36(487)33(23)24h81012141619212834H11131718H217H3(H3842)(H3943)(H4044)t2834m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(1(2methoxyethyl)1Hindol4yl)Lvalinamide
ZINC000150653543
ZINC150653543

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Available files

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