Vitas-M small molecule compound
3-(3,4,5-trimethoxybenzyl)-3,4,7,8,9,10-hexahydro-2H,6H-benzo[3,4]chromeno[8,7-e][1,3]oxazin-6-one
Catalog ID
STL463147
SMILES COc1cc(CN2COc3c(C2)c2oc(=O)c4c(c2cc3)CCCC4)cc(c1OC)OC
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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 C25H27NO6 MW 437.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27NO6/c1-28-21-10-15(11-22(29-2)24(21)30-3)12-26-13-19-20(31-14-26)9-8-17-16-6-4-5-7-18(16)25(27)32-23(17)19/h8-11H,4-7,12-14H2,1-3H3InChIKey
IWNCZUJXGTWBJB-UHFFFAOYSA-NSynonyms
858763-33-43((345trimethoxyphenyl)methyl)2478910hexahydroisochromeno(34f)(13)benzoxazin6one
3(345trimethoxybenzyl)3478910hexahydro2H6Hbenzo(34)chromeno(87e)(13)oxazin6one
3(345trimethoxybenzyl)3478910hexahydrobenzo(34)chromeno(87e)(13)oxazin6(2H)one
858763334
COC1=CC(=CC(=C1OC)OC)CN2CC3=C(C=CC4=C3OC(=O)C5=C4CCCC5)OC2
InChI=1SC25H27NO6c128211015(1122(292)24(21)303)1226131920(311426)981716645718(16)25(27)3223(17)19h811H471214H213H3
MFCD04143717
ZINC000055396265
ZINC55396265
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