John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=IuOBSEl00dJ

(accessed ).
Isotocin
SpectraBase Compound ID IuOBSEl00dJ
InChI InChI=1S/C41H63N11O12S2/c1-5-20(3)32(39(62)45-16-31(44)56)51-38(61)29-8-7-13-52(29)41(64)28-19-66-65-18-24(42)34(57)46-25(14-22-9-11-23(54)12-10-22)36(59)50-33(21(4)6-2)40(63)48-27(17-53)37(60)47-26(15-30(43)55)35(58)49-28/h9-12,20-21,24-29,32-33,53-54H,5-8,13-19,42H2,1-4H3,(H2,43,55)(H2,44,56)(H,45,62)(H,46,57)(H,47,60)(H,48,63)(H,49,58)(H,50,59)(H,51,61)
InChIKey XMINXPSYULINQV-UHFFFAOYSA-N
Mol Weight 966.1 g/mol
Molecular Formula C41H63N11O12S2
Exact Mass 965.409911 g/mol
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