Vitas-M small molecule compound
3-[3-(2-phenyl-1H-indol-1-yl)propanoyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Catalog ID
STL468489
SMILES O=C(N1CC2CC(C1)c1n(C2)c(=O)ccc1)CCn1c(cc2c1cccc2)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 C28H27N3O2 MW 437.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N3O2/c32-27(29-17-20-15-23(19-29)25-11-6-12-28(33)31(25)18-20)13-14-30-24-10-5-4-9-22(24)16-26(30)21-7-2-1-3-8-21/h1-12,16,20,23H,13-15,17-19H2InChIKey
YXXZWCFXRIVIPT-UHFFFAOYSA-NSynonyms
(1R5S)3(3(2phenyl1Hindol1yl)propanoyl)3456tetrahydro1H15methanopyrido(12a)(15)diazocin8(2H)one
3(3(2phenyl1Hindol1yl)propanoyl)123456hexahydro8H15methanopyrido(12a)(15)diazocin8one
C1C2CN(CC1C3=CC=CC(=O)N3C2)C(=O)CCN4C5=CC=CC=C5C=C4C6=CC=CC=C6
InChI=1SC28H27N3O2c3227(2917201523(1929)251161228(33)31(25)1820)131430241054922(24)1626(30)217213821h112162023H13151719H2
MFCD31751010
O=C(N1C(C@@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1)CCn1c(cc2c1cccc2)c1ccccc1
ZINC000071745158
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