Vitas-M small molecule compound
3-(2-{[3-(4-methoxyphenyl)-2-methyl-4-oxo-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
STL512046
SMILES COc1ccc(cc1)c1c(C)oc2c(c1=O)ccc(c2)OCCN1CC2CC(C1)c1n(C2)c(=O)ccc1
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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 C30H30N2O5 MW 498.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30N2O5/c1-19-29(21-6-8-23(35-2)9-7-21)30(34)25-11-10-24(15-27(25)37-19)36-13-12-31-16-20-14-22(18-31)26-4-3-5-28(33)32(26)17-20/h3-11,15,20,22H,12-14,16-18H2,1-2H3InChIKey
BNNGYPJGSHPZJA-UHFFFAOYSA-NSynonyms
1105215-64-2(1R5S)3(2((3(4methoxyphenyl)2methyl4oxo4Hchromen7yl)oxy)ethyl)3456tetrahydro1H15methanopyrido(12a)(15)diazocin8(2H)one
11(2(3(4methoxyphenyl)2methyl4oxochromen7yl)oxyethyl)711diazatricyclo(7310^(27))trideca24dien6one
1105215642
3(2((3(4methoxyphenyl)2methyl4oxo4Hchromen7yl)oxy)ethyl)123456hexahydro8H15methanopyrido(12a)(15)diazocin8one
44117770
COc1ccc(cc1)c1c(C)oc2c(c1=O)ccc(c2)OCCN1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1
InChI=1SC30H30N2O5c11929(216823(352)9721)30(34)25111024(1527(25)3719)3613123116201422(1831)2643528(33)32(26)1720h311152022H12141618H212H3
MFCD11999718
ZINC000008878571
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