Vitas-M small molecule compound
16-phenyl-2,3,4,6,7,11,12,16-octahydro-1H,10H-[1,4]dioxepino[2',3':6,7]isoquino[2,1-a]quinolin-1-one
Catalog ID
STK593788
SMILES O=C1CCCC2=C1C(C=C1N2CCc2c1cc1OCCCOc1c2)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 C26H25NO3 MW 399.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25NO3/c28-23-9-4-8-21-26(23)20(17-6-2-1-3-7-17)15-22-19-16-25-24(29-12-5-13-30-25)14-18(19)10-11-27(21)22/h1-3,6-7,14-16,20H,4-5,8-13H2InChIKey
RINUBBZLSNRDLP-UHFFFAOYSA-NSynonyms
16phenyl23467111216octahydro1H10H(14)dioxepino(2367)isoquino(21a)quinolin1one
16phenyl346710111216octahydro(14)dioxepino(2367)isoquinolino(21a)quinolin1(2H)one
C1CC2=C(C(C=C3N2CCC4=CC5=C(C=C43)OCCCO5)C6=CC=CC=C6)C(=O)C1
InChI=1SC26H25NO3c28239482126(23)20(176213717)152219162524(29125133025)1418(19)101127(21)22h1367141620H45813H2
MFCD07641235
ZINC000005451836
ZINC000005451837
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