Vitas-M small molecule compound

(2R,6R,2'R,6'R)-2,2'-methanediylbis(13-oxadispiro[5.0.5.1]tridecan-1-one)

Catalog ID
STL525723
SMILES O=C1[C@H](CCC[C@@]21OC12CCCCC1)C[C@H]1CCC[C@@]2(C1=O)OC12CCCCC1

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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 C25H36O4 MW 400.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H36O4/c26-20-18(9-7-15-24(20)22(28-24)11-3-1-4-12-22)17-19-10-8-16-25(21(19)27)23(29-25)13-5-2-6-14-23/h18-19H,1-17H2/t18-,19-,24+,25+/m1/s1
InChIKey
SRXHLHLYMDYESA-WHBJXLRSSA-N
Synonyms

(2R6R)2(((2R6R)1oxo13oxadispiro(505^(7)1^(6))tridecan2yl)methyl)13oxadispiro(505^(7)1^(6))tridecan1onehydrate
(2R6R2R6R)22methanediylbis(13oxadispiro(5051)tridecan1one)
(7~(R)11~(R))11(((7~(R)11~(R))12oxo13oxadispiro(505^(7)1^(6))tridecan11yl)methyl)13oxadispiro(505^(7)1^(6))tridecan12one
(7R11R)11(((7R11R)12OXO13OXADISPIRO(505(7)1(6))TRIDECAN11YL)METHYL)13OXADISPIRO(505(7)1(6))TRIDECAN12ONE
2((1oxo13oxadispiro(505^(7)1^(6))tridecan2yl)methyl)13oxadispiro(505^(7)1^(6))tridecan1one
7077644
InChI=1SC25H36O4c262018(971524(20)22(2824)113141222)17191081625(21(19)27)23(2925)135261423h1819H117H2t181924+25+m1s1
MFCD01084280
O=C1(C@H)(CCC(C@@)21OC12CCCCC1)C(C@H)1CCC(C@@)2(C1=O)OC12CCCCC1O
O=C1C(CCCC21OC12CCCCC1)CC1CCCC2(C1=O)OC12CCCCC1
ZINC000004027769
ZINC4027769

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Available files

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