Vitas-M small molecule compound
(4aR,6aS,8Z)-8-[5-(acetylamino)-4-iodopentan-2-ylidene]-4a,6a,7-trimethyl-2,3,4,4a,4b,5,6,6a,6b,7,8,9a,10,10a,10b,11-hexadecahydro-1H-naphtho[2',1':4,5]indeno[2,1-b]furan-2-yl acetate (non-preferred name)
Catalog ID
STL524746
SMILES IC(C/C(=C/1\OC2C(C1C)[C@@]1(C(C2)C2CC=C3[C@](C2CC1)(C)CCC(C3)OC(=O)C)C)/C)CNC(=O)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 C31H46INO4 MW 623.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H46INO4/c1-17(13-22(32)16-33-19(3)34)29-18(2)28-27(37-29)15-26-24-8-7-21-14-23(36-20(4)35)9-11-30(21,5)25(24)10-12-31(26,28)6/h7,18,22-28H,8-16H2,1-6H3,(H,33,34)/b29-17-/t18?,22?,23?,24?,25?,26?,27?,28?,30-,31-/m0/s1InChIKey
KGBSGBJFEOXATN-DKEJJYDPSA-NSynonyms
((6~(Z)9~(S)13~(R))6(5acetamido4iodopentan2ylidene)7913trimethyl5oxapentacyclo(10800^(29)0^(48)0^(1318))icos18en16yl)acetate
(4aR6aS8Z)8(5(acetylamino)4iodopentan2ylidene)4a6a7trimethyl2344a4b566a6b789a1010a10b11hexadecahydro1Hnaphtho(2145)indeno(21b)furan2ylacetate(nonpreferredname)
(6aR8aSZ)10(5acetamido4iodopentan2ylidene)6a8a9trimethyl34566a6b788a8b91011a1212a12bhexadecahydro1Hnaphtho(2145)indeno(21b)furan4ylacetate
16395063
IC(CC(=C1OC2C(C1C)(C@@)1(C(C2)C2CC=C3(C@)(C2CC1)(C)CCC(C3)OC(=O)C)C)C)CNC(=O)C
InChI=1SC31H46INO4c117(1322(32)163319(3)34)2918(2)2827(3729)15262487211423(3620(4)35)91130(215)25(24)101231(2628)6h7182228H816H216H3(H3334)b2917t18?22?23?24?25?26?27?28?3031m0s1
MFCD01543510
ZINC000254492581
ZINC000257198863
Check stock
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