Vitas-M small molecule compound
methyl N-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbonyl)-beta-alaninate
Catalog ID
STL320538
SMILES COC(=O)CCNC(=O)c1ccc2c(c1)OCCCO2
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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 C14H17NO5 MW 279.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H17NO5/c1-18-13(16)5-6-15-14(17)10-3-4-11-12(9-10)20-8-2-7-19-11/h3-4,9H,2,5-8H2,1H3,(H,15,17)InChIKey
WWNOATHFRJZYRV-UHFFFAOYSA-NSynonyms
1292498-89-51292498895
COC(=O)CCNC(=O)C1=CC2=C(C=C1)OCCCO2
InChI=1SC14H17NO5c11813(16)561514(17)10341112(910)208271911h349H258H21H3(H1517)
methyl3(34dihydro2H15benzodioxepine7carbonylamino)propanoate
methyl3(34dihydro2Hbenzo(b)(14)dioxepine7carboxamido)propanoate
methylN(34dihydro2H15benzodioxepin7ylcarbonyl)betaalaninate
MFCD28029551
ZINC000032989252
ZINC32989252
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