5928-25-6
DECURSIN
Name
DECURSIN
Formula
C19 H20 O5
MolWeight
328.362
1Identification
【Name】
DECURSIN
【CAS】
【MDL】
MFCD00272154
【English Synonyms】
【Formula】
C19 H20 O5
【MolWeight】
328.362
【Inchi】
InChI=1S/C19H20O5/c1-11(2)7-18(21)23-16-9-13-8-12-5-6-17(20)22-14(12)10-15(13)24-19(16,3)4/h5-8,10,16H,9H2,1-4H3/t16-/m0/s1
【InChIKey】
InChIKey=CUKSFECWKQBVED-INIZCTEOSA-N
【SMILES】
CC(=CC(=O)O[C@H]1Cc2cc3ccc(=O)oc3cc2OC1(C)C)C
【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
DECURSIN.cml
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