Vitas-M small molecule compound
(3beta,8xi,9xi,14xi,17xi,20xi)-cholest-5-en-3-yl 2,4,6-tribromophenyl carbonate
Catalog ID
STL546222
SMILES CC(CCCC(C1CCC2[C@]1(C)CCC1C2CC=C2[C@]1(C)CC[C@@H](C2)OC(=O)Oc1c(Br)cc(cc1Br)Br)C)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 C34H47Br3O3 MW 743.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H47Br3O3/c1-20(2)7-6-8-21(3)26-11-12-27-25-10-9-22-17-24(13-15-33(22,4)28(25)14-16-34(26,27)5)39-32(38)40-31-29(36)18-23(35)19-30(31)37/h9,18-21,24-28H,6-8,10-17H2,1-5H3/t21?,24-,25?,26?,27?,28?,33-,34+/m0/s1InChIKey
IXJLLFHKEXZIQZ-HDFJOFGLSA-NSynonyms
((3~(S)10~(R)13~(R))1013dimethyl17(6methylheptan2yl)234789111214151617dodecahydro1~(H)cyclopenta(a)phenanthren3yl)(246tribromophenyl)carbonate
(3beta8xi9xi14xi17xi20xi)cholest5en3yl246tribromophenylcarbonate
(3S10R13R17R)1013dimethyl17((R)6methylheptan2yl)2347891011121314151617tetradecahydro1Hcyclopenta(a)phenanthren3yl(246tribromophenyl)carbonate
135639734
CC(CCC(C@H)((C@H)1CCC2(C@)1(C)CCC1C2CC=C2(C@)1(C)CC(C@@H)(C2)OC(=O)Oc1c(Br)cc(cc1Br)Br)C)C
InChI=1SC34H47Br3O3c120(2)76821(3)2611122725109221724(131533(224)28(25)141634(2627)5)3932(38)403129(36)1823(35)1930(31)37h918212428H681017H215H3t21?2425?26?27?28?3334+m0s1
ZINC000504529037
ZINC001772492685
Check stock
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Check stock on Vitas-MAvailable files
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