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6-[5'-{6"-[(2S,5R)-5"'-Bromotetrahydro-2"',6"',6"'-trimethyl-2H-pyran-2"'-yl]octahydro-8"a-methylpyrano[3,2-b]pyran-2"-yl}tetrahydro-5'-methylfuran-2'-yl]-2-methylheptane-1,2,6-triol

View entire compound with spectra: 1 MS (GC)

6-[5'-{6"-[(2S,5R)-5"'-Bromotetrahydro-2"',6"',6"'-trimethyl-2H-pyran-2"'-yl]octahydro-8"a-methylpyrano[3,2-b]pyran-2"-yl}tetrahydro-5'-methylfuran-2'-yl]-2-methylheptane-1,2,6-triol
SpectraBase Compound ID 314mNMNEfa7
InChI InChI=1S/C30H53BrO7/c1-25(2,33)20(32)12-15-27(5,34)21-13-17-29(7,36-21)24-10-9-22-28(6,37-24)18-14-23(35-22)30(8)16-11-19(31)26(3,4)38-30/h19-24,32-34H,9-18H2,1-8H3/t19-,20?,21+,22-,23-,24-,27?,28+,29-,30+/m1/s1
InChIKey LDQVWFLDLPYOLQ-FGOZMZMRSA-N
Mol Weight 605.7 g/mol
Molecular Formula C30H53BrO7
Exact Mass 604.297467 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K5sdRVEw4Da
Name 6-[5'-{6"-[(2S,5R)-5"'-Bromotetrahydro-2"',6"',6"'-trimethyl-2H-pyran-2"'-yl]octahydro-8"a-methylpyrano[3,2-b]pyran-2"-yl}tetrahydro-5'-methylfuran-2'-yl]-2-methylheptane-1,2,6-triol
Alternate Name(s) Laurenmariannol 6-[(2S,5R)-5-[(2R,4aS,6R,8aR)-2-[(2S,5R)-5-bromo-2,6,6-trimethyl-2-oxanyl]-4a-methyl-3,4,6,7,8,8a-hexahydro-2H-pyrano[3,2-b]pyran-6-yl]-5-methyl-2-oxolanyl]-2-methylheptane-2,3,6-triol 6-[(2S,5R)-5-[(2R,4aS,6R,8aR)-2-[(2S,5R)-5-bromo-2,6,6-trimethyloxan-2-yl]-4a-methyl-3,4,6,7,8,8a-hexahydro-2H-pyrano[3,2-b]pyran-6-yl]-5-methyloxolan-2-yl]-2-methylheptane-2,3,6-triol 6-[(2S,5R)-5-[(2R,4aS,6R,8aR)-2-[(2S,5R)-5-bromanyl-2,6,6-trimethyl-oxan-2-yl]-4a-methyl-3,4,6,7,8,8a-hexahydro-2H-pyrano[3,2-b]pyran-6-yl]-5-methyl-oxolan-2-yl]-2-methyl-heptane-2,3,6-triol
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Formula C30H53BrO7
InChI InChI=1S/C30H53BrO7/c1-25(2,33)20(32)12-15-27(5,34)21-13-17-29(7,36-21)24-10-9-22-28(6,37-24)18-14-23(35-22)30(8)16-11-19(31)26(3,4)38-30/h19-24,32-34H,9-18H2,1-8H3/t19-,20?,21+,22-,23-,24-,27?,28+,29-,30+/m1/s1
InChIKey LDQVWFLDLPYOLQ-FGOZMZMRSA-N
Molecular Weight 605.651 g/mol
SMILES OC(C(CCC([C@]1(O[C@@]([C@@]2(O[C@]3(CC[C@@](O[C@@]3(CC2)[H])([C@]2(OC([C@@](CC2)(Br)[H])(C)C)C)[H])C)[H])(CC1)C)[H])(O)C)O)(C)C
SPLASH splash10-056r-1390000000-cd4c5993503cdd69d14f
Source of Spectrum H-91-1945-1
Wiley ID 1693470