Vitas-M small molecule compound

4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl N-[(benzyloxy)carbonyl]-D-tryptophanate

Catalog ID
STL532339
SMILES O=C(N[C@@H](C(=O)Oc1ccc2c(c1)oc(=O)c1c2CCC1)Cc1c[nH]c2c1cccc2)OCc1ccccc1

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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 C31H26N2O6 MW 522.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H26N2O6/c34-29-25-11-6-10-23(25)24-14-13-21(16-28(24)39-29)38-30(35)27(15-20-17-32-26-12-5-4-9-22(20)26)33-31(36)37-18-19-7-2-1-3-8-19/h1-5,7-9,12-14,16-17,27,32H,6,10-11,15,18H2,(H,33,36)/t27-/m1/s1
InChIKey
XGKRHSVQURYHRP-HHHXNRCGSA-N
Synonyms

(4oxo23dihydro1~(H)cyclopenta(c)chromen7yl)(2~(R))3(1~(H)indol3yl)2(phenylmethoxycarbonylamino)propanoate
(S)4oxo1234tetrahydrocyclopenta(c)chromen7yl2(((benzyloxy)carbonyl)amino)3(1Hindol3yl)propanoate
135639407
4oxo1234tetrahydrocyclopenta(c)chromen7ylN((benzyloxy)carbonyl)Dtryptophanate
InChI=1SC31H26N2O6c3429251161023(25)24141321(1628(24)3929)3830(35)27(15201732261254922(20)26)3331(36)3718197213819h1579121416172732H610111518H2(H3336)t27m1s1
O=C(N(C@H)(C(=O)Oc1ccc2c(c1)oc(=O)c1c2CCC1)Cc1c(nH)c2c1cccc2)OCc1ccccc1
ZINC000016042349

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Available files

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