Vitas-M small molecule compound
(3alpha,8xi,9xi,14xi,16xi,17xi,20xi)-26-(acetylamino)-22-ethoxyfurost-5-en-3-yl acetate
Catalog ID
STL525152
SMILES CCOC1(CCC(CNC(=O)C)C)OC2C(C1C)[C@@]1(C(C2)C2CC=C3[C@](C2CC1)(C)CC[C@H](C3)OC(=O)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 C33H53NO5 MW 543.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H53NO5/c1-8-37-33(16-11-20(2)19-34-22(4)35)21(3)30-29(39-33)18-28-26-10-9-24-17-25(38-23(5)36)12-14-31(24,6)27(26)13-15-32(28,30)7/h9,20-21,25-30H,8,10-19H2,1-7H3,(H,34,35)/t20?,21?,25-,26?,27?,28?,29?,30?,31+,32+,33?/m1/s1InChIKey
JYSKEYJPUQOIED-WCAQWCEWSA-NSynonyms
((9~(S)13~(R)16~(R))6(4acetamido3methylbutyl)6ethoxy7913trimethyl5oxapentacyclo(10800^(29)0^(48)0^(1318))icos18en16yl)acetate
(3alpha8xi9xi14xi16xi17xi20xi)26(acetylamino)22ethoxyfurost5en3ylacetate
(4R6aR6bS8aS8bR9S11aS12aS12bS)10(4acetamido3methylbutyl)10ethoxy6a8a9trimethyl34566a6b788a8b91011a1212a12bhexadecahydro1Hnaphtho(2145)indeno(21b)furan4ylacetate
75366877
CCOC1(CCC(CNC(=O)C)C)O(C@@H)2(C@H)((C@@H)1C)(C@@)1((C@@H)(C2)(C@@H)2CC=C3(C@)((C@H)2CC1)(C)CC(C@H)(C3)OC(=O)C)C
InChI=1SC33H53NO5c183733(161120(2)193422(4)35)21(3)3029(3933)182826109241725(3823(5)36)121431(246)27(26)131532(2830)7h920212530H81019H217H3(H3435)t20?21?2526?27?28?29?30?31+32+33?m1s1
MFCD01547809
ZINC000253533772
ZINC000253533780
Check stock
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Check stock on Vitas-MAvailable files
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