Vitas-M small molecule compound
(8xi,9xi,14xi,16xi,17xi)-26-(acetylamino)furosta-5,20(22)-dien-3-yl 4-methylpentanoate
Catalog ID
STL526801
SMILES CC(CCC1=C(C)C2C(O1)CC1[C@]2(C)CCC2C1CC=C1[C@]2(C)CCC(C1)OC(=O)CCC(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 C35H55NO4 MW 553.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H55NO4/c1-21(2)8-13-32(38)39-26-14-16-34(6)25(18-26)10-11-27-28(34)15-17-35(7)29(27)19-31-33(35)23(4)30(40-31)12-9-22(3)20-36-24(5)37/h10,21-22,26-29,31,33H,8-9,11-20H2,1-7H3,(H,36,37)/t22?,26?,27?,28?,29?,31?,33?,34-,35-/m0/s1InChIKey
ZBSYSDJYMWIJFZ-MCYIPGGUSA-NSynonyms
((9~(S)13~(R))6(4acetamido3methylbutyl)7913trimethyl5oxapentacyclo(10800^(29)0^(48)0^(1318))icosa618dien16yl)4methylpentanoate
(6aR8aS)10(4acetamido3methylbutyl)6a8a9trimethyl34566a6b788a8b11a1212a12btetradecahydro1Hnaphtho(2145)indeno(21b)furan4yl4methylpentanoate
(8xi9xi14xi16xi17xi)26(acetylamino)furosta520(22)dien3yl4methylpentanoate
16397573
CC(CCC1=C(C)C2C(O1)CC1(C@)2(C)CCC2C1CC=C1(C@)2(C)CCC(C1)OC(=O)CCC(C)C)CNC(=O)C
InChI=1SC35H55NO4c121(2)81332(38)3926141634(6)25(1826)10112728(34)151735(7)29(27)193133(35)23(4)30(4031)12922(3)203624(5)37h10212226293133H891120H217H3(H3637)t22?26?27?28?29?31?33?3435m0s1
MFCD03006551
ZINC000253502826
ZINC000253502840
ZINC12660724
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.