Vitas-M small molecule compound

methyl 4a,6a-dimethyl-2,5'-dioxo-2,4,4',4a,5',5a,6,6a,8,9,9a,9b,10,11-tetradecahydro-3H,3'H-spiro[cyclopenta[7,8]phenanthro[4b,5-b]oxirene-7,2'-furan]-10-carboxylate

Catalog ID
STL451057
SMILES COC(=O)C1CC2=CC(=O)CCC2(C23C1C1CCC4(C1(C)CC3O2)CCC(=O)O4)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 C24H30O6 MW 414.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H30O6/c1-21-7-4-14(25)10-13(21)11-15(20(27)28-3)19-16-5-8-23(9-6-18(26)30-23)22(16,2)12-17-24(19,21)29-17/h10,15-17,19H,4-9,11-12H2,1-3H3
InChIKey
JUKPWJGBANNWMW-UHFFFAOYSA-N
Synonyms

CC12CCC(=O)C=C1CC(C3C24C(O4)CC5(C3CCC56CCC(=O)O6)C)C(=O)OC
InChI=1SC24H30O6c1217414(25)1013(21)1115(20(27)283)19165823(9618(26)3023)22(162)121724(1921)2917h10151719H491112H213H3
methyl4a6adimethyl25dioxo2444a55a66a899a9b1011tetradecahydro3H3Hspiro(cyclopenta(78)phenanthro(4b5b)oxirene72furan)10carboxylate
MFCD31439699
ZINC000252515430
ZINC000257149533

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Available files

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