Vitas-M small molecule compound

(3R,5S)-1,6-bis(2,4-dimethoxyphenyl)dispiro[2.1.2.3]decan-4-one

Catalog ID
STL526044
SMILES COc1cc(OC)ccc1C1C[C@@]21CCC[C@]1(C2=O)CC1c1ccc(cc1OC)OC

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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 C26H30O5 MW 422.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30O5/c1-28-16-6-8-18(22(12-16)30-3)20-14-25(20)10-5-11-26(24(25)27)15-21(26)19-9-7-17(29-2)13-23(19)31-4/h6-9,12-13,20-21H,5,10-11,14-15H2,1-4H3/t20?,21?,25-,26+
InChIKey
NLWKUVKXSDFLCE-HWUWZZFZSA-N
Synonyms
1212472-07-5
(3~(R)5~(S))26bis(24dimethoxyphenyl)dispiro(212^(5)3^(3))decan4one
(3R5S)16bis(24dimethoxyphenyl)dispiro(212^(5)3^(3))decan4one
(3R5S)16bis(24dimethoxyphenyl)dispiro(2123)decan4one
1212472075
16395539
COc1cc(OC)ccc1C1C(C@@)21CCC(C@)1(C2=O)CC1c1ccc(cc1OC)OC
InChI=1SC26H30O5c128166818(22(1216)303)201425(20)1051126(24(25)27)1521(26)199717(292)1323(19)314h6912132021H510111415H214H3t20?21?2526+
MFCD01545366
ZINC000015885480
ZINC000100741633

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Available files

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