Vitas-M small molecule compound
spirostan-3,5-diol
Catalog ID
STL372880
SMILES CC1CCC2(OC1)OC1C(C2C)C2(C(C1)C1CCC3(C(C1CC2)(C)CCC(C3)O)O)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 C27H44O4 MW 432.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H44O4/c1-16-5-12-27(30-15-16)17(2)23-22(31-27)13-21-19-7-11-26(29)14-18(28)6-10-25(26,4)20(19)8-9-24(21,23)3/h16-23,28-29H,5-15H2,1-4H3InChIKey
STPSRYKELIQVSH-UHFFFAOYSA-NSynonyms
(2aR2R4S5R6aR8aS8bR9S11aS12bS)56a8a9tetramethyldocosahydrospiro(naphtho(2145)indeno(21b)furan102pyran)2a4diol
C(C@@H)1CC(C@@)2(OC1)O(C@@H)1(C@H)((C@@H)2C)(C@@)2(C(C1)(C@@H)1CC(C@@)3((C@)(C1CC2)(C)CC(C@@H)(C3)O)O)C
CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6(C5(CCC(C6)O)C)O)C)C)OC1
InChI=1SC27H44O4c11651227(301516)17(2)2322(3127)13211971126(29)1418(28)61025(264)20(19)8924(2123)3h16232829H515H214H3
MFCD28952433
SPIROSTAN35DIOL
ZINC000253596570
ZINC000253596573
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