Vitas-M small molecule compound

N-[(3-tert-butyl-5,9-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetyl]-L-tryptophan

Catalog ID
STL531623
SMILES O=C(Cc1c(=O)oc2c(c1C)cc1c(c2C)occ1C(C)(C)C)N[C@H](C(=O)O)Cc1c[nH]c2c1cccc2

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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 C30H30N2O6 MW 514.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30N2O6/c1-15-19-11-21-22(30(3,4)5)14-37-26(21)16(2)27(19)38-29(36)20(15)12-25(33)32-24(28(34)35)10-17-13-31-23-9-7-6-8-18(17)23/h6-9,11,13-14,24,31H,10,12H2,1-5H3,(H,32,33)(H,34,35)/t24-/m0/s1
InChIKey
WSJUUOXAKIXAMP-DEOSSOPVSA-N
Synonyms
956050-72-9
(2~(S))2((2(3~(tert)butyl59dimethyl7oxofuro(32g)chromen6yl)acetyl)amino)3(1~(H)indol3yl)propanoicacid
(2S)2((2(3TERTBUTYL59DIMETHYL7OXOFURO(32G)CHROMEN6YL)ACETYL)AMINO)3(1HINDOL3YL)PROPANOICACID
(S)2(2(3(TERTBUTYL)59DIMETHYL7OXO7HFURO(32G)CHROMEN6YL)ACETAMIDO)3(1HINDOL3YL)PROPANOICACID
1767858
956050729
InChI=1SC30H30N2O6c11519112122(30(34)5)143726(21)16(2)27(19)3829(36)20(15)1225(33)3224(28(34)35)1017133123976818(17)23h691113142431H1012H215H3(H3233)(H3435)t24m0s1
N((3tertbutyl59dimethyl7oxo7Hfuro(32g)chromen6yl)acetyl)Ltryptophan
O=C(Cc1c(=O)oc2c(c1C)cc1c(c2C)occ1C(C)(C)C)N(C@H)(C(=O)O)Cc1c(nH)c2c1cccc2
ZINC000002112943
ZINC2112943

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Available files

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