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Vesiculosin
[CAS# 96935-20-5]

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CAS#: 96935-20-5
Product: Vesiculosin
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Identification
Name Vesiculosin
Synonyms B671071k103; Nsc374342; Vesculosin (B671071k103)
Molecular Structure CAS#: 96935-20-5, Vesiculosin
Molecular Formula C30H42O9
Molecular Weight 546.66
CAS Registry Number 96935-20-5
SMILES C(O)C12OC1C4C(O)(C3C(O)(C2O)C(=O)C(=C3)C)C(CC(O)(C4OC(=O)\C=C\C=C\CCCCC)C(=C)C)C
InChI 1S/C30H42O9/c1-6-7-8-9-10-11-12-13-21(32)38-24-22-25-28(16-31,39-25)26(34)30(37)20(14-18(4)23(30)33)29(22,36)19(5)15-27(24,35)17(2)3/h10-14,19-20,22,24-26,31,34-37H,2,6-9,15-16H2,1,3-5H3/b11-10+,13-12+
InChIKey GTNHSMYOEDNTOZ-AQASXUMVSA-N
Properties
Density 1.313g/cm3 (Cal.)
Boiling point 718.583°C at 760 mmHg (Cal.)
Flash point 229.844°C (Cal.)
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