Vitas-M small molecule compound

(2S,2'R,5'R,6'S,8a'S)-5-(2-hydroxyethyl)-5,5'-bis(hydroxymethyl)-2',5',8a'-trimethyldecahydro-2'H,3H-spiro[furan-2,1'-naphthalen]-6'-ol

Catalog ID
STK063823
SMILES OCCC1(CO)CC[C@]2(O1)[C@H](C)CCC1[C@]2(C)CC[C@@H]([C@@]1(C)CO)O

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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 C20H36O5 MW 356.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H36O5/c1-14-4-5-15-17(2,12-22)16(24)6-7-18(15,3)20(14)9-8-19(13-23,25-20)10-11-21/h14-16,21-24H,4-13H2,1-3H3/t14-,15?,16+,17+,18+,19?,20+/m1/s1
InChIKey
XYPPDQHBNJURHU-SSLRCSEFSA-N
Synonyms
385767-68-0
((1R2R5S5R6S8aS)6hydroxy5(2hydroxyethyl)258atrimethyldecahydro2H3Hspiro(furan21naphthalene)55diyl)dimethanol
(1R2S4aS5S6R)5(2hydroxyethyl)15bis(hydroxymethyl)14a6trimethylspiro(346788ahexahydro2Hnaphthalene52oxolane)2ol
(2R2R5S5R6S8AS)5(2HYDROXYETHYL)55BIS(HYDROXYMETHYL)258ATRIMETHYLDECAHYDRO2H3HSPIRO(FURAN21NAPHTHALEN)6OL
(2S2R5R6S8AS)5(2HYDROXYETHYL)55BIS(HYDROXYMETHYL)258ATRIMETHYLDECAHYDRO2H3HSPIRO(FURAN21NAPHTHALEN)6OL
385767680
CC1CCC2C(C13CCC(O3)(CCO)CO)(CCC(C2(C)CO)O)C
InChI=1SC20H36O5c114451517(21222)16(24)6718(153)20(14)9819(13232520)101121h14162124H413H213H3t1415?16+17+18+19?20+m1s1
MFCD13368362
OCC(C@)1(CO)CC(C@@)2(O1)(C@H)(C)CCC1(C@)2(C)CC(C@@H)((C@@)1(C)CO)O
OCCC1(CO)CC(C@)2(O1)(C@H)(C)CCC1(C@)2(C)CC(C@@H)((C@@)1(C)CO)O
STK063823
ZINC000004424621
ZINC000005528116

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Available files

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