Vitas-M small molecule compound
[3-{bis[2-(hydroxy-kappaO)ethyl]amino-kappaN}-2-(hydroxy-kappaO)propyl (3-methoxyphenyl)carbamatato(3-)]boron
Catalog ID
STL325873
SMILES COc1cccc(c1)NC(=O)OCC1C[N+]23[B-](O1)(OCC3)OCC2
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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 C15H21BN2O6 MW 336.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H21BN2O6/c1-20-13-4-2-3-12(9-13)17-15(19)21-11-14-10-18-5-7-22-16(18,24-14)23-8-6-18/h2-4,9,14H,5-8,10-11H2,1H3,(H,17,19)InChIKey
POHDATQFVSMOFW-UHFFFAOYSA-NSynonyms
(3(bis(2(hydroxykappaO)ethyl)aminokappaN)2(hydroxykappaO)propyl(3methoxyphenyl)carbamatato(3))boron
(B)123(N+)(CCO1)(CCO2)CC(O3)COC(=O)NC4=CC(=CC=C4)OC
2((((3methoxyphenyl)carbamoyl)oxy)methyl)tetrahydro84(epoxyethano)(132)oxazaborolo(23b)(132)oxazaborol4ium8uide
COc1cccc(c1)NC(=O)OCC1C(N+)23(B)(O1)(OCC3)OCC2
InChI=1SC15H21BN2O6c1201342312(913)1715(19)2111141018572216(182414)238618h24914H581011H21H3(H1719)
MFCD00384743
ZINC000195831942
ZINC000195831946
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