Vitas-M small molecule compound
4-(methoxycarbonyl)phenyl 4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxylate
Catalog ID
STK852960
SMILES COC(=O)c1ccc(cc1)OC(=O)C12CCC(C2(C)C)(C(=O)O1)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 C18H20O6 MW 332.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20O6/c1-16(2)17(3)9-10-18(16,24-14(17)20)15(21)23-12-7-5-11(6-8-12)13(19)22-4/h5-8H,9-10H2,1-4H3InChIKey
HNVWKUVHPFSVSU-UHFFFAOYSA-NSynonyms
618400-79-6(1S4S)4(methoxycarbonyl)phenyl477trimethyl3oxo2oxabicyclo(221)heptane1carboxylate
(4METHOXYCARBONYLPHENYL)177TRIMETHYL2OXO3OXABICYCLO(221)HEPTANE4CARBOXYLATE
4(METHOXYCARBONYL)PHENYL(1R4S)477TRIMETHYL3OXO2OXABICYCLO(221)HEPTANE1CARBOXYLATE
4(methoxycarbonyl)phenyl477trimethyl3oxo2oxabicyclo(221)heptane1carboxylate
4(METHOXYCARBONYL)PHENYL477TRIMETHYL3OXO2OXABICYCLO(221)HEPTANECARBOXYLATE
618400796
CC1(C2(CCC1(OC2=O)C(=O)OC3=CC=C(C=C3)C(=O)OC)C)C
InChI=1SC18H20O6c116(2)17(3)91018(162414(17)20)15(21)23127511(6812)13(19)224h58H910H214H3
MFCD06278055
ZINC000002891103
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