Vitas-M small molecule compound
4',4',6'-trimethyl-2'-oxo-1,4-dihydro-4'H-spiro[3,1-benzoxazine-2,1'-pyrrolo[3,2,1-ij]quinolin]-8'-yl 3,4,5-trimethoxybenzoate
Catalog ID
STK210224
SMILES COc1c(OC)cc(cc1OC)C(=O)Oc1cc2C(=CC(N3c2c(c1)C1(OCc2c(N1)cccc2)C3=O)(C)C)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 C31H30N2O7 MW 542.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30N2O7/c1-17-15-30(2,3)33-26-21(17)13-20(40-28(34)19-11-24(36-4)27(38-6)25(12-19)37-5)14-22(26)31(29(33)35)32-23-10-8-7-9-18(23)16-39-31/h7-15,32H,16H2,1-6H3InChIKey
AAJANQJOXYGZKQ-UHFFFAOYSA-NSynonyms
446trimethyl2oxo14dihydro4Hspiro(31benzoxazine21pyrrolo(321ij)quinolin)8yl345trimethoxybenzoate
CC1=CC(N2C3=C(C=C(C=C13)OC(=O)C4=CC(=C(C(=C4)OC)OC)OC)C5(C2=O)NC6=CC=CC=C6CO5)(C)C
InChI=1SC31H30N2O7c1171530(23)332621(17)1320(4028(34)191124(364)27(386)25(1219)375)1422(26)31(29(33)35)32231087918(23)163931h71532H16H216H3
MFCD06192377
ZINC000002442481
ZINC000002442483
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