Vitas-M small molecule compound

4-nitrobenzyl N-(tert-butoxycarbonyl)glycylalanylglycylphenylalanylphenylalaninate

Catalog ID
STK370232
SMILES O=C(NC(C(=O)NC(C(=O)OCc1ccc(cc1)[N+](=O)[O-])Cc1ccccc1)Cc1ccccc1)CNC(=O)C(NC(=O)CNC(=O)OC(C)(C)C)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 C37H44N6O10 MW 732.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H44N6O10/c1-24(40-31(44)22-39-36(49)53-37(2,3)4)33(46)38-21-32(45)41-29(19-25-11-7-5-8-12-25)34(47)42-30(20-26-13-9-6-10-14-26)35(48)52-23-27-15-17-28(18-16-27)43(50)51/h5-18,24,29-30H,19-23H2,1-4H3,(H,38,46)(H,39,49)(H,40,44)(H,41,45)(H,42,47
InChIKey
GYIYVRCURJSFKE-UHFFFAOYSA-N
Synonyms

(4NITROPHENYL)METHYL2((2((2(2((2((2METHYLPROPAN2YL)OXYCARBONYLAMINO)ACETYL)AMINO)PROPANOYLAMINO)ACETYL)AMINO)3PHENYLPROPANOYL)AMINO)3PHENYLPROPANOATE
(4NITROPHENYL)METHYL2(2(2(2(2((TERTBUTOXY)CARBONYLAMINO)ACETYLAMINO)PROPANOYLAMINO)ACETYLAMINO)3PHENYLPROPANOYLAMINO)3PHENYLPROPANOATE
4nitrobenzylN(tertbutoxycarbonyl)glycylalanylglycylphenylalanylphenylalaninate
CC(C(=O)NCC(=O)NC(CC1=CC=CC=C1)C(=O)NC(CC2=CC=CC=C2)C(=O)OCC3=CC=C(C=C3)(N+)(=O)(O))NC(=O)CNC(=O)OC(C)(C)C
InChI=1SC37H44N6O10c124(4031(44)223936(49)5337(23)4)33(46)382132(45)4129(1925117581225)34(47)4230(20261396101426)35(48)522327151728(181627)43(50)51h518242930H1923H214H3(H3846)(H3949)(H4044)(H4145)(H4247)
MFCD00302550
O=C(NC(C(=O)NC(C(=O)OCc1ccc(cc1)(N+)(=O)(O))Cc1ccccc1)Cc1ccccc1)CNC(=O)C(NC(=O)CNC(=O)OC(C)(C)C)C
ZINC000004018306
ZINC000150662736

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Available files

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