Vitas-M small molecule compound
3-[3-(1,2,3,4-tetrahydro-9H-carbazol-9-yl)propanoyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Catalog ID
STL476444
SMILES O=C(N1CC2CC(C1)c1n(C2)c(=O)ccc1)CCn1c2CCCCc2c2c1cccc2
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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 C26H29N3O2 MW 415.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3O2/c30-25(27-15-18-14-19(17-27)22-10-5-11-26(31)29(22)16-18)12-13-28-23-8-3-1-6-20(23)21-7-2-4-9-24(21)28/h1,3,5-6,8,10-11,18-19H,2,4,7,9,12-17H2InChIKey
NDOXNLXJQPIPIR-UHFFFAOYSA-NSynonyms
(1R5S)3(3(34dihydro1Hcarbazol9(2H)yl)propanoyl)3456tetrahydro1H15methanopyrido(12a)(15)diazocin8(2H)one
3(3(1234tetrahydro9Hcarbazol9yl)propanoyl)123456hexahydro8H15methanopyrido(12a)(15)diazocin8one
C1CCC2=C(C1)C3=CC=CC=C3N2CCC(=O)N4CC5CC(C4)C6=CC=CC(=O)N6C5
InChI=1SC26H29N3O2c3025(2715181419(1727)221051126(31)29(22)1618)12132823831620(23)21724924(21)28h1356810111819H24791217H2
MFCD31751360
O=C(N1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1)CCn1c2CCCCc2c2c1cccc2
ZINC000225415010
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