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Debromoaplysiatoxin
[CAS# 52423-28-6]

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CAS#: 52423-28-6
Product: Debromoaplysiatoxin
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Identification
Name Debromoaplysiatoxin
Synonyms Aplysiatoxin, 17-Debromo-; Brn 4624539; G-2408
Molecular Structure CAS#: 52423-28-6, Debromoaplysiatoxin
Molecular Formula C32H48O10
Molecular Weight 592.73
CAS Registry Number 52423-28-6
SMILES C4=C(C(CCC(C2OC13OC(CC(OC(CC(OC(C1)C2C)=O)C(O)C)=O)(C(C)CC3(C)C)O)C)OC)C=CC=C4O
InChI 1S/C32H48O10/c1-18(11-12-24(38-7)22-9-8-10-23(34)13-22)29-20(3)26-16-32(41-29)30(5,6)15-19(2)31(37,42-32)17-28(36)39-25(21(4)33)14-27(35)40-26/h8-10,13,18-21,24-26,29,33-34,37H,11-12,14-17H2,1-7H3
InChIKey REAZZDPREXHWNV-UHFFFAOYSA-N
Properties
Density 1.241g/cm3 (Cal.)
Boiling point 762.158°C at 760 mmHg (Cal.)
Flash point 239.021°C (Cal.)
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