Vitas-M small molecule compound
17,21-dihydroxy-9,11-epoxypregn-4-ene-3,20-dione
Catalog ID
STL533864
SMILES OCC(=O)C1(O)CCC2C1(C)CC1OC31C2CCC1=CC(=O)CCC31C
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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 C21H28O5 MW 360.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28O5/c1-18-7-5-13(23)9-12(18)3-4-15-14-6-8-20(25,16(24)11-22)19(14,2)10-17-21(15,18)26-17/h9,14-15,17,22,25H,3-8,10-11H2,1-2H3InChIKey
FJCQSIDXADHVFH-UHFFFAOYSA-NSynonyms
(4aS4bS5aS6aS7R9bS)7hydroxy7(2hydroxyacetyl)4a6adimethyl44a5a66a7899a9b1011dodecahydrocyclopenta(12)phenanthro(44ab)oxiren2(3H)one
14hydroxy14(2hydroxyacetyl)215dimethyl18oxapentacyclo(8800^(117)0^(27)0^(1115))octadec6en5one
1721dihydroxy911epoxypregn4ene320dione
537166
CORTICOSTERONE17ALPHAHYDROXY11DEHYDROXY911EPOXY
InChI=1SC21H28O5c1187513(23)912(18)3415146820(2516(24)1122)19(142)101721(1518)2617h91415172225H381011H212H3
MFCD31754011
OCC(=O)(C@@)1(O)CCC2(C@)1(C)C(C@@H)1O(C@@)31(C@H)2CCC1=CC(=O)CC(C@)31C
ZINC000503932770
ZINC000503932783
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