5058-13-9
COLUMBIANADIN
Name
COLUMBIANADIN
Formula
C19 H20 O5
MolWeight
328.362
1Identification
【Name】
COLUMBIANADIN
【CAS】
【MDL】
MFCD07781426
【English Synonyms】
【Formula】
C19 H20 O5
【MolWeight】
328.362
【Inchi】
InChI=1S/C19H20O5/c1-5-11(2)18(21)24-19(3,4)15-10-13-14(22-15)8-6-12-7-9-16(20)23-17(12)13/h5-9,15H,10H2,1-4H3/b11-5-/t15-/m0/s1
【InChIKey】
InChIKey=JRIBPWOXWIRQOQ-GHAIFCDISA-N
【SMILES】
C/C=C(/C)\C(=O)OC(C)(C)[C@@H]1Cc2c(ccc3c2oc(=O)cc3)O1
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
COLUMBIANADIN.cml
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