Vitas-M small molecule compound
(5xi,9xi,13xi,17xi,18xi)-lup-20(29)-ene-3,28-diyl bis(4-methylbenzenesulfonate)
Catalog ID
STL526104
SMILES Cc1ccc(cc1)S(=O)(=O)OCC12CC[C@H](C2C2[C@](CC1)(C)[C@]1(C)CCC3[C@](C1CC2)(C)CCC(C3(C)C)OS(=O)(=O)c1ccc(cc1)C)C(=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 C44H62O6S2 MW 751.10 g/mol Purity >90% as per NMR
InChI
InChI=1S/C44H62O6S2/c1-29(2)34-20-25-44(28-49-51(45,46)32-14-10-30(3)11-15-32)27-26-42(8)35(39(34)44)18-19-37-41(7)23-22-38(40(5,6)36(41)21-24-43(37,42)9)50-52(47,48)33-16-12-31(4)13-17-33/h10-17,34-39H,1,18-28H2,2-9H3/t34-,35?,36?,37?,38?,39?,41-,42+,43+InChIKey
AYIBIENYUPMCJM-XHWLBMEASA-NSynonyms
((1~(R)5~(a)~(R)5~(b)~(R)11~(a)~(R))5~(a)5~(b)8811~(a)pentamethyl9(4methylphenyl)sulfonyloxy1prop1en2yl12345677~(a)9101111~(b)121313~(a)13~(b)hexadecahydrocyclopenta(a)chrysen3~(a)yl)methyl4methylbenzenesulfonate
(1R5aR5bR11aR)5a5b8811apentamethyl1(prop1en2yl)3a((tosyloxy)methyl)icosahydro1Hcyclopenta(a)chrysen9yl4methylbenzenesulfonate
(5xi9xi13xi17xi18xi)lup20(29)ene328diylbis(4methylbenzenesulfonate)
16396770
Cc1ccc(cc1)S(=O)(=O)OCC12CC(C@H)(C2C2(C@)(CC1)(C)(C@)1(C)CCC3(C@)(C1CC2)(C)CCC(C3(C)C)OS(=O)(=O)c1ccc(cc1)C)C(=C)C
InChI=1SC44H62O6S2c129(2)34202544(284951(4546)32141030(3)111532)272642(8)35(39(34)44)18193741(7)232238(40(56)36(41)212443(3742)9)5052(4748)33161231(4)131733h10173439H11828H229H3t3435?36?37?38?39?4142+43+44?m0s1
MFCD02058668
ZINC000253504141
ZINC000253504161
Check stock
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