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Calamistrin G
SpectraBase Compound ID 4yK6AG7jLOY
InChI InChI=1S/C37H66O6/c1-3-4-5-6-16-19-22-31(38)33-24-26-35(42-33)36-27-25-34(43-36)32(39)23-20-17-14-12-10-8-7-9-11-13-15-18-21-30-28-29(2)41-37(30)40/h28-29,31-36,38-39H,3-27H2,1-2H3/t29-,31+,32+,33?,34?,35?,36?/m0/s1
InChIKey UOSMEKCGZPLXIC-IXVCWCKPSA-N
Mol Weight 606.9 g/mol
Molecular Formula C37H66O6
Exact Mass 606.48594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 96BcYOr29W0
Name Calamistrin G
Alternate Name(s) (5S)-3-[(15R)-15-hydroxy-15-(5-{5-[(1R)-1-hydroxynonyl]oxolan-2-yl}oxolan-2-yl)pentadecyl]-5-methyl-2,5-dihydrofuran-2-one
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Formula C37H66O6
InChI InChI=1S/C37H66O6/c1-3-4-5-6-16-19-22-31(38)33-24-26-35(42-33)36-27-25-34(43-36)32(39)23-20-17-14-12-10-8-7-9-11-13-15-18-21-30-28-29(2)41-37(30)40/h28-29,31-36,38-39H,3-27H2,1-2H3/t29-,31+,32+,33?,34?,35?,36?/m0/s1
InChIKey UOSMEKCGZPLXIC-IXVCWCKPSA-N
Molecular Weight 606.929 g/mol
SMILES O[C@@](C1OC(C2OC([C@@](CCCCCCCCCCCCCCC=3C(O[C@@](C)(C3)[H])=O)(O)[H])CC2)CC1)(CCCCCCCC)[H]
SPLASH splash10-00di-0009000000-bcb3e2f46b1e99eed3f5
Source of Spectrum G4-63-1204-5
Wiley ID 1608582