Vitas-M small molecule compound
3-{2-[(4-oxo-3-phenyl-4H-chromen-7-yl)oxy]ethyl}-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Catalog ID
STL512038
SMILES O=c1c(coc2c1ccc(c2)OCCN1CC2CC(C1)c1n(C2)c(=O)ccc1)c1ccccc1
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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 C28H26N2O4 MW 454.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N2O4/c31-27-8-4-7-25-21-13-19(16-30(25)27)15-29(17-21)11-12-33-22-9-10-23-26(14-22)34-18-24(28(23)32)20-5-2-1-3-6-20/h1-10,14,18-19,21H,11-13,15-17H2InChIKey
MYYFTXDEUWGRON-UHFFFAOYSA-NSynonyms
1105241-77-7(1R5S)3(2((4oxo3phenyl4Hchromen7yl)oxy)ethyl)3456tetrahydro1H15methanopyrido(12a)(15)diazocin8(2H)one
11(2(4oxo3phenylchromen7yl)oxyethyl)711diazatricyclo(7310^(27))trideca24dien6one
1105241777
3(2((4oxo3phenyl4Hchromen7yl)oxy)ethyl)123456hexahydro8H15methanopyrido(12a)(15)diazocin8one
44117764
InChI=1SC28H26N2O4c312784725211319(1630(25)27)1529(1721)111233229102326(1422)341824(28(23)32)205213620h11014181921H11131517H2
MFCD11999712
O=c1c(coc2c1ccc(c2)OCCN1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1)c1ccccc1
ZINC000008878413
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