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Isovesiculosin
[CAS# 96935-22-7]

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CAS#: 96935-22-7
Product: Isovesiculosin
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Identification
Name Isovesiculosin
Synonyms Isovesiculosin; Nsc374343; Vesculosin, Iso (B671071k104)
Molecular Structure CAS#: 96935-22-7, Isovesiculosin
Molecular Formula C30H42O9
Molecular Weight 546.66
CAS Registry Number 96935-22-7
SMILES C(O)C12OC1C4C(O)(C3C(O)(C2O)C(=O)C(=C3)C)C(CC(OC(=O)\C=C\C=C\CCCCC)(C4O)C(=C)C)C
InChI 1S/C30H42O9/c1-6-7-8-9-10-11-12-13-21(32)38-27(17(2)3)15-19(5)29(36)20-14-18(4)23(33)30(20,37)26(35)28(16-31)25(39-28)22(29)24(27)34/h10-14,19-20,22,24-26,31,34-37H,2,6-9,15-16H2,1,3-5H3/b11-10+,13-12+
InChIKey YVVNYYRTWOFPMR-AQASXUMVSA-N
Properties
Density 1.313g/cm3 (Cal.)
Boiling point 706.231°C at 760 mmHg (Cal.)
Flash point 225.275°C (Cal.)
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List of Reports Available for Isovesiculosin
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