Vitas-M small molecule compound
(10R,13S,17R)-6-formyl-3-methoxy-10,13-dimethyl-1,2,7,8,9,10,11,12,13,14,15,16-dodecahydrodispiro[cyclopenta[a]phenanthrene-17,4'-[1,3]dioxolane-5',4''-[1,3]dioxolan]-11-yl trifluoroacetate
Catalog ID
STL564550
SMILES O=CC1=C2C=C(OC)CC[C@@]2(C2C(C1)C1CC[C@]3([C@]1(CC2OC(=O)C(F)(F)F)C)OCOC13COCO1)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 C27H33F3O8 MW 542.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H33F3O8/c1-23-6-4-16(33-3)9-19(23)15(11-31)8-17-18-5-7-25(26(37-14-35-25)12-34-13-36-26)24(18,2)10-20(21(17)23)38-22(32)27(28,29)30/h9,11,17-18,20-21H,4-8,10,12-14H2,1-3H3/t17?,18?,20?,21?,23-,24-,25+,26?/m0/s1InChIKey
AZUQQHPTAMFSRK-GJIDGCNXSA-NSynonyms
(10R13S17R)6formyl3methoxy1013dimethyl1278910111213141516dodecahydrodispiro(cyclopenta(a)phenanthrene174(13)dioxolane54(13)dioxolan)11yltrifluoroacetate
(2R3R15S)8formyl5methoxy215dimethyldispiro(bis((14)dioxolane)22314tetracyclo(8700^(27)0^(1115))heptadecane)57dien17yl222trifluoroacetate
16396116
InChI=1SC20H22N2Oc1147815(2)17(1114)1220(23)2110916132219643518(16)19h38111322H91012H212H3(H2123)
MFCD32651501
O=CC1=C2C=C(OC)CC(C@@)2(C2C(C1)C1CC(C@)3((C@)1(CC2OC(=O)C(F)(F)F)C)OCOC13COCO1)C
ZINC000253498919
ZINC000253498924
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