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Vitas-M small molecule compound

N-{[(6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy]acetyl}-L-alanyl-L-tryptophan

Catalog ID
STK921404
SMILES O=C(N[C@H](C(=O)N[C@H](C(=O)O)Cc1c[nH]c2c1cccc2)C)COc1ccc2c(c1)oc(=O)c1c2CCCC1

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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 C29H29N3O7 MW 531.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29N3O7/c1-16(27(34)32-24(28(35)36)12-17-14-30-23-9-5-4-6-19(17)23)31-26(33)15-38-18-10-11-21-20-7-2-3-8-22(20)29(37)39-25(21)13-18/h4-6,9-11,13-14,16,24,30H,2-3,7-8,12,15H2,1H3,(H,31,33)(H,32,34)(H,35,36)/t16-,24-/m0/s1
InChIKey
VIRHHEQMCQPPFZ-FYSMJZIKSA-N
Synonyms

(2S)3(1Hindol3yl)2(((2S)2((2((6oxo78910tetrahydrobenzo(c)chromen3yl)oxy)acetyl)amino)propanoyl)amino)propanoicacid
(S)3(1Hindol3yl)2((R)2(2((6oxo78910tetrahydro6Hbenzo(c)chromen3yl)oxy)acetamido)propanamido)propanoicacid
CC(C(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)O)NC(=O)COC3=CC4=C(C=C3)C5=C(CCCC5)C(=O)O4
InChI=1SC29H29N3O7c116(27(34)3224(28(35)36)1217143023954619(17)23)3126(33)15381810112120723822(20)29(37)3925(21)1318h469111314162430H23781215H21H3(H3133)(H3234)(H3536)t1624m0s1
MFCD10040730
N(((6oxo78910tetrahydro6Hbenzo(c)chromen3yl)oxy)acetyl)LalanylLtryptophan
O=C(N(C@@H)(C(=O)N(C@H)(C(=O)O)Cc1c(nH)c2c1cccc2)C)COc1ccc2c(c1)oc(=O)c1c2CCCC1
O=C(N(C@H)(C(=O)N(C@H)(C(=O)O)Cc1c(nH)c2c1cccc2)C)COc1ccc2c(c1)oc(=O)c1c2CCCC1
ZINC000102625322
ZINC102625322

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Available files

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