ChemicalBook--->CAS DataBase List--->473451-73-9

473451-73-9

473451-73-9 Structure

473451-73-9 Structure
IdentificationBack Directory
[Name]

Carpinontriol B
[CAS]

473451-73-9
[Synonyms]

Carpinontriol B
PubChem ID: 132487818
Tricyclo[12.3.1.12,6]nonadeca-1(18),2,4,6(19),14,16-hexaen-9-one, 3,10,11,12,17-pentahydroxy-, (1S,10R,11S,12S)-
[Molecular Formula]

C19H20O6
[MOL File]

473451-73-9.mol
[Molecular Weight]

344.36
Chemical PropertiesBack Directory
[Melting point ]

232-235 °C
[Boiling point ]

648.3±55.0 °C(Predicted)
[density ]

1.440±0.06 g/cm3(Predicted)
[pka]

9.43±0.70(Predicted)
[InChI]

InChI=1S/C19H20O6/c20-14-4-1-10-2-6-16(22)18(24)19(25)17(23)9-11-3-5-15(21)13(8-11)12(14)7-10/h1,3-5,7-8,17-21,23-25H,2,6,9H2
[InChIKey]

HXRHVUWGMADGQP-UHFFFAOYSA-N
[SMILES]

OC1C=CC2CC(C(C(O)C(=O)CCC3C=CC(O)=C(C=3)C=1C=2)O)O
Hazard InformationBack Directory
[Uses]

Carpinontriol B is a natural diarylheptanoid compound[1].
[References]

[1] Ji Sun Lee, et al. New diarylheptanoids from the stems of Carpinus cordata. J Nat Prod. 2002 Sep;65(9):1367-70. DOI:10.1021/np020048l
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