Vitas-M small molecule compound

(8R,9S,10R,13S,14S,17R)-3-ethoxy-10,13-dimethyl-1,2,3',4',7,8,9,10,11,12,13,14,15,16-tetradecahydro-5'H-spiro[cyclopenta[a]phenanthrene-17,2'-furan]-5'-one

Catalog ID
STK801811
SMILES CCOC1=CC2=CC[C@@H]3[C@@H]([C@]2(CC1)C)CC[C@]1([C@H]3CC[C@]21CCC(=O)O2)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 C24H34O3 MW 370.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H34O3/c1-4-26-17-7-11-22(2)16(15-17)5-6-18-19(22)8-12-23(3)20(18)9-13-24(23)14-10-21(25)27-24/h5,15,18-20H,4,6-14H2,1-3H3/t18-,19+,20+,22+,23+,24-/m1/s1
InChIKey
PFOMZLRVGKNKCE-PXFMPXEPSA-N
Synonyms
2649-76-5
(17R)3ETHOXY17HYDROXYPREGNA35DIENE21CARBOXYLICACIDGAMMALACTONE
(2R10R13S)3ethoxy1013dimethyl1278910111213141516dodecahydro3Hspiro(cyclopenta(a)phenanthrene172furan)5(4H)one
(8R9S10R13S14S17R)3ethoxy1013dimethyl123478910111213141516tetradecahydro5Hspiro(cyclopenta(a)phenanthrene172furan)5one
(8R9S10R13S14S17R)3ethoxy1013dimethylspiro(127891112141516decahydrocyclopenta(a)phenanthrene175oxolane)2one
2649765
3ETHOXYPREGNA46DIENE21CARBOXYLICACIDHYDROXYGAMMALACTONE
ALDONAETHYLENOLETHER
CCOC1=CC2=CC(C@@H)3(C@@H)((C@)2(CC1)C)CC(C@)1((C@H)3CC(C@)21CCC(=O)O2)C
CCOC1=CC2=CCC3C((C@)2(CC1)C)CC(C@)1(C3CC(C@)21CCC(=O)O2)C
CCOC1=CC2=CCC3C(C2(CC1)C)CCC4(C3CCC45CCC(=O)O5)C
InChI=1SC24H34O3c14261771122(2)16(1517)561819(22)81223(3)20(18)91324(23)141021(25)2724h5151820H4614H213H3t1819+20+22+23+24m1s1
MFCD09859135
PREGNA35DIENE21CARBOXYLICACID3ETHOXY17HYDROXYGAMMALACTONE(17ALPHA)
ZINC000003881675
ZINC03881675
ZINC3881675

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Available files

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