Vitas-M small molecule compound
26-(acetylamino)-16-ethylfurosta-5,20(22)-dien-3-yl acetate
Catalog ID
STK366231
SMILES CCC12OC(=C(C2C2(C(C1)C1CC=C3C(C1CC2)(C)CCC(C3)OC(=O)C)C)C)CCC(CNC(=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 C33H51NO4 MW 525.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H51NO4/c1-8-33-18-28-26-11-10-24-17-25(37-23(5)36)13-15-31(24,6)27(26)14-16-32(28,7)30(33)21(3)29(38-33)12-9-20(2)19-34-22(4)35/h10,20,25-28,30H,8-9,11-19H2,1-7H3,(H,34,35)InChIKey
MYAHWDSLERLMNA-UHFFFAOYSA-NSynonyms
(6aR8aS)10(4acetamido3methylbutyl)11aethyl6a8a9trimethyl34566a6b788a8b11a1212a12btetradecahydro1Hnaphtho(2145)indeno(21b)furan4ylacetate
26(acetylamino)16ethylfurosta520(22)dien3ylacetate
CCC12CC3C4CC=C5CC(CCC5(C4CCC3(C1C(=C(O2)CCC(C)CNC(=O)C)C)C)C)OC(=O)C
CCC12OC(=C(C2(C@@)2(C(C1)C1CC=C3(C@)(C1CC2)(C)CCC(C3)OC(=O)C)C)C)CCC(CNC(=O)C)C
InChI=1SC33H51NO4c18331828261110241725(3723(5)36)131531(246)27(26)141632(287)30(33)21(3)29(3833)12920(2)193422(4)35h1020252830H891119H217H3(H3435)
MFCD00317341
ZINC000253498118
ZINC000253498121
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