Vitas-M small molecule compound

N-[(2,3,5-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetyl]norleucyl-L-phenylalanine

Catalog ID
STK574593
SMILES CCCCC(C(=O)N[C@H](C(=O)O)Cc1ccccc1)NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)oc(c1C)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 C31H34N2O7 MW 546.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H34N2O7/c1-5-6-12-24(29(35)33-25(30(36)37)13-20-10-8-7-9-11-20)32-28(34)15-23-18(3)22-14-21-17(2)19(4)39-26(21)16-27(22)40-31(23)38/h7-11,14,16,24-25H,5-6,12-13,15H2,1-4H3,(H,32,34)(H,33,35)(H,36,37)/t24?,25-/m0/s1
InChIKey
KTMWHFTZSCRQNE-BBMPLOMVSA-N
Synonyms

(2S)3phenyl2(2((2(235trimethyl7oxofuro(32g)chromen6yl)acetyl)amino)hexanoylamino)propanoicacid
(2S)3phenyl2(2(2(235trimethyl7oxo7Hfuro(32g)chromen6yl)acetamido)hexanamido)propanoicacid
CCCCC(C(=O)N(C@H)(C(=O)O)Cc1ccccc1)NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)oc(c1C)C
CCCCC(C(=O)NC(CC1=CC=CC=C1)C(=O)O)NC(=O)CC2=C(C3=CC4=C(C=C3OC2=O)OC(=C4C)C)C
InChI=1SC31H34N2O7c1561224(29(35)3325(30(36)37)1320108791120)3228(34)152318(3)22142117(2)19(4)3926(21)1627(22)4031(23)38h71114162425H56121315H214H3(H3234)(H3335)(H3637)t24?25m0s1
MFCD10488029
N((235trimethyl7oxo7Hfuro(32g)chromen6yl)acetyl)norleucylLphenylalanine
ZINC000101367178
ZINC000101367179

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.