Vitas-M small molecule compound
2-phenylethyl 4-(6-chloro-4-oxo-4H-chromen-3-yl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK019145
SMILES Clc1ccc2c(c1)c(=O)c(co2)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)OCCc1ccccc1
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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 C30H28ClNO5 MW 518.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28ClNO5/c1-17-25(29(35)36-12-11-18-7-5-4-6-8-18)26(27-22(32-17)14-30(2,3)15-23(27)33)21-16-37-24-10-9-19(31)13-20(24)28(21)34/h4-10,13,16,26,32H,11-12,14-15H2,1-3H3InChIKey
VUFUHKILPSQTCU-UHFFFAOYSA-NSynonyms
2phenylethyl4(6chloro4oxo4Hchromen3yl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
2phenylethyl4(6chloro4oxochromen3yl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=COC4=C(C3=O)C=C(C=C4)Cl)C(=O)OCCC5=CC=CC=C5
Clc1ccc2c(c1)c(=O)c(co2)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)OCCc1ccccc1
InChI=1SC30H28ClNO5c11725(29(35)361211187546818)26(2722(3217)1430(23)1523(27)33)2116372410919(31)1320(24)28(21)34h41013162632H11121415H213H3
MFCD01824518
STK019145
ZINC000001189196
ZINC000001189202
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