Vitas-M small molecule compound
[(1R,9R)-4-hexyl-6,8,9-trimethyl-3-oxabicyclo[3.3.1]non-6-en-1-yl]methyl butylcarbamate
Catalog ID
STL562167
SMILES CCCCCCC1OC[C@@]2([C@H](C1C(=CC2C)C)C)COC(=O)NCCCC
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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 C23H41NO3 MW 379.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H41NO3/c1-6-8-10-11-12-20-21-17(3)14-18(4)23(15-26-20,19(21)5)16-27-22(25)24-13-9-7-2/h14,18-21H,6-13,15-16H2,1-5H3,(H,24,25)/t18?,19-,20?,21?,23-/m1/s1InChIKey
BLVSFQBWYSMWEE-XKFVAKCWSA-NSynonyms
1212432-31-9((1R9R)4hexyl689trimethyl3oxabicyclo(331)non6en1yl)methylbutylcarbamate
((1R9R)4hexyl689trimethyl3oxabicyclo(331)non6en1yl)methylNbutylcarbamate
1212432319
16396101
CCCCCCC1OC(C@@)2((C@@H)(C1C(=CC2C)C)C)COC(=O)NCCCC
InChI=1SC23H41NO3c168101112202117(3)1418(4)23(15262019(21)5)162722(25)2413972h141821H6131516H215H3(H2425)t18?1920?21?23m1s1
MFCD01547686
ZINC000100742930
ZINC000105364985
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