Vitas-M small molecule compound
(8xi,9xi,14xi)-16-methyl-20-oxopregna-5,16-dien-3-yl acetate
Catalog ID
STL524413
SMILES CC(=O)OC1CC[C@]2(C(=CCC3C2CC[C@]2(C3CC(=C2C(=O)C)C)C)C1)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/c1-14-12-21-19-7-6-17-13-18(27-16(3)26)8-10-23(17,4)20(19)9-11-24(21,5)22(14)15(2)25/h6,18-21H,7-13H2,1-5H3/t18?,19?,20?,21?,23-,24-/m0/s1InChIKey
NELMHAIFXJZDST-DQZREHOBSA-NSynonyms
((10~(R)13~(S))17acetyl101316trimethyl23478911121415decahydro1~(H)cyclopenta(a)phenanthren3yl)acetate
(3S8R10R13S)17acetyl101316trimethyl234789101112131415dodecahydro1Hcyclopenta(a)phenanthren3ylacetate
(8xi9xi14xi)16methyl20oxopregna516dien3ylacetate
135638943
CC(=O)O(C@H)1CC(C@)2(C(=CC(C@@H)3C2CC(C@)2(C3CC(=C2C(=O)C)C)C)C1)C
InChI=1SC24H34O3c11412211976171318(2716(3)26)81023(174)20(19)91124(215)22(14)15(2)25h61821H713H215H3t18?19?20?21?2324m0s1
MFCD01545211
ZINC000001188458
ZINC001772491771
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