Vitas-M small molecule compound

methyl 6,7-didehydro-2,20-cycloaspidospermidine-3-carboxylate

Catalog ID
STK369168
SMILES COC(=O)C1CC23C(C41Nc1c(C54C3N(CC5)CC=C2)cccc1)C

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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 C21H24N2O2 MW 336.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O2/c1-13-19-8-5-10-23-11-9-20(18(19)23)14-6-3-4-7-16(14)22-21(13,20)15(12-19)17(24)25-2/h3-8,13,15,18,22H,9-12H2,1-2H3
InChIKey
JSLDLCGKZDUQSH-UHFFFAOYSA-N
Synonyms
6822-38-4
(3aR3a1S5R5aR10bR14R)methyl14methyl3a14561112hexahydro1H3a5amethanoindolizino(81cd)carbazole5carboxylatedihydrochloride
220CYCLOASPIDOSPERMIDINE3CARBOXYLICACID67DIDEHYDROMETHYLESTER(2ALPHA3ALPHA5ALPHA12BETA19ALPHA20R)
3EPIVINDOLININE
6822384
CC1C23CC(C14C5(C2N(CC5)CC=C3)C6=CC=CC=C6N4)C(=O)OC
COC(=O)(C@@H)1C(C@)23(C@H)((C@)41Nc1c((C@@)54(C@H)3N(CC5)CC=C2)cccc1)CClCl
InChI=1SC21H24N2O2c1131985102311920(18(19)23)14634716(14)2221(1320)15(1219)17(24)252h3813151822H912H212H3
ISOUINDOLININE
ISOVINDOLININE
methyl67didehydro220cycloaspidospermidine3carboxylate
MFCD00600540
ZINC000195303412
ZINC000245225733

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.