Vitas-M small molecule compound

N-[3-(2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]-D-tryptophyl-beta-alanine

Catalog ID
STL529816
SMILES O=C(N[C@@H](C(=O)NCCC(=O)O)Cc1c[nH]c2c1cccc2)CCc1c(=O)oc2c(c1C)cc1c(c2C)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 C32H33N3O7 MW 571.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H33N3O7/c1-16-19(4)41-29-18(3)30-24(14-23(16)29)17(2)21(32(40)42-30)9-10-27(36)35-26(31(39)33-12-11-28(37)38)13-20-15-34-25-8-6-5-7-22(20)25/h5-8,14-15,26,34H,9-13H2,1-4H3,(H,33,39)(H,35,36)(H,37,38)/t26-/m1/s1
InChIKey
TVHPPFMRSDWPCF-AREMUKBSSA-N
Synonyms
956970-12-0
(R)3(3(1Hindol3yl)2(3(2359tetramethyl7oxo7Hfuro(32g)chromen6yl)propanamido)propanamido)propanoicacid
16406153
3(((2~(R))3(1~(H)indol3yl)2(3(2359tetramethyl7oxofuro(32g)chromen6yl)propanoylamino)propanoyl)amino)propanoicacid
956970120
InChI=1SC32H33N3O7c11619(4)412918(3)3024(1423(16)29)17(2)21(32(40)4230)91027(36)3526(31(39)33121128(37)38)1320153425865722(20)25h5814152634H913H214H3(H3339)(H3536)(H3738)t26m1s1
MFCD08002469
N(3(2359tetramethyl7oxo7Hfuro(32g)chromen6yl)propanoyl)Dtryptophylbetaalanine
O=C(N(C@@H)(C(=O)NCCC(=O)O)Cc1c(nH)c2c1cccc2)CCc1c(=O)oc2c(c1C)cc1c(c2C)oc(c1C)C
ZINC000070707020
ZINC70707020

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Available files

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