Vitas-M small molecule compound

methyl (3S)-1-(3,4,5-trimethoxyphenyl)-2,3,4,9-tetrahydro-1H-beta-carboline-3-carboxylate

Catalog ID
STL457991
SMILES COC(=O)[C@H]1NC(c2cc(OC)c(c(c2)OC)OC)c2c(C1)c1ccccc1[nH]2

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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 C22H24N2O5 MW 396.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N2O5/c1-26-17-9-12(10-18(27-2)21(17)28-3)19-20-14(11-16(24-19)22(25)29-4)13-7-5-6-8-15(13)23-20/h5-10,16,19,23-24H,11H2,1-4H3/t16-,19?/m0/s1
InChIKey
COBLTLPBNAVOBY-UCFFOFKASA-N
Synonyms

COC(=O)(C@H)1NC(c2cc(OC)c(c(c2)OC)OC)c2c(C1)c1ccccc1(nH)2
COC(=O)C1NC(c2cc(OC)c(c(c2)OC)OC)c2c(C1)c1ccccc1(nH)2
COC1=CC(=CC(=C1OC)OC)C2C3=C(CC(N2)C(=O)OC)C4=CC=CC=C4N3
InChI=1SC22H24N2O5c12617912(1018(272)21(17)283)192014(1116(2419)22(25)294)13756815(13)2320h51016192324H11H214H3t1619?m0s1
methyl(3S)1(345trimethoxyphenyl)2349tetrahydro1Hbetacarboline3carboxylate
methyl(3S)1(345trimethoxyphenyl)2349tetrahydro1Hpyrido(34b)indole3carboxylate
methyl1(345trimethoxyphenyl)2349tetrahydro1Hpyrido(34b)indole3carboxylate
ZINC000036025425
ZINC000036025426

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Available files

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