Vitas-M small molecule compound
N-(4-{[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]amino}butanoyl)-L-phenylalanine
Catalog ID
STL544767
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NCCCC(=O)N[C@H](C(=O)O)Cc2ccccc2)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 C34H39N3O8 MW 617.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H39N3O8/c1-20(38)36-25-14-12-22-18-29(43-2)32(44-3)33(45-4)31(22)23-13-15-26(28(39)19-24(23)25)35-16-8-11-30(40)37-27(34(41)42)17-21-9-6-5-7-10-21/h5-7,9-10,13,15,18-19,25,27H,8,11-12,14,16-17H2,1-4H3,(H,35,39)(H,36,38)(H,37,40)(H,41,42)/t25-,InChIKey
DEHGZUUVVNBUTM-BDYUSTAISA-NSynonyms
(2~(S))2(4(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)butanoylamino)3phenylpropanoicacid
(S)2(4(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)butanamido)3phenylpropanoicacid
110208148
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)NCCCC(=O)N(C@H)(C(=O)O)Cc2ccccc2)NC(=O)C)cc(c1OC)OC
InChI=1SC34H39N3O8c120(38)36251412221829(432)32(443)33(454)31(22)23131526(28(39)1924(23)25)351681130(40)3727(34(41)42)172196571021h57910131518192527H81112141617H214H3(H3539)(H3638)(H3740)(H4142)t2527m0s1
N(4(((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)butanoyl)Lphenylalanine
ZINC000253399661
ZINC253399661
Check stock
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Check stock on Vitas-MAvailable files
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