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8-beta-Hydroxy-Verrucarin J
[CAS# 77101-87-2]

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CAS#: 77101-87-2
Product: 8-beta-Hydroxy-Verrucarin J
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Identification
Name 8-beta-Hydroxy-Verrucarin J
Synonyms Verrucarin A, 2',3'-Didehydro-2'-Deoxy-8-Hydroxy-, (2'Z,8R)-; Verrucarin L; Verrucarin A, 2',3'-Didehydro-2'-Deoxy-8-Hydroxy-, (2'E,8S)-
Molecular Structure CAS#: 77101-87-2, 8-beta-Hydroxy-Verrucarin J
Molecular Formula C27H32O9
Molecular Weight 500.54
CAS Registry Number 77101-87-2
SMILES CC24C1(OC1)C5OC3C2(CC(O)C(=C3)C)COC(=O)\C=C(CCOC(=O)/C=C\C=C/C(OC4C5)=O)\C
InChI 1S/C27H32O9/c1-16-8-9-32-22(29)6-4-5-7-23(30)36-19-12-21-27(15-34-27)25(19,3)26(14-33-24(31)10-16)13-18(28)17(2)11-20(26)35-21/h4-7,10-11,18-21,28H,8-9,12-15H2,1-3H3/b6-4-,7-5-,16-10-
InChIKey BOMPKFLFSCDGLF-VQUMIJSSSA-N
Properties
Density 1.348g/cm3 (Cal.)
Boiling point 778.902°C at 760 mmHg (Cal.)
Flash point 262.439°C (Cal.)
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