521-32-4
BILOBETIN
Name
BILOBETIN
Formula
C31 H20 O10
MolWeight
552.489
1Identification
【Name】
BILOBETIN
【CAS】
【MDL】
MFCD00597036
【English Synonyms】
【Formula】
C31 H20 O10
【MolWeight】
552.489
【Inchi】
InChI=1S/C31H20O10/c1-39-24-7-4-15(26-12-22(37)29-19(34)9-17(33)10-27(29)40-26)8-18(24)28-20(35)11-21(36)30-23(38)13-25(41-31(28)30)14-2-5-16(32)6-3-14/h2-13,32-36H,1H3
【InChIKey】
InChIKey=IWEIJEPIYMAGTH-UHFFFAOYSA-N
【SMILES】
COc1ccc(cc1c2c(cc(c3c2oc(cc3=O)c4ccc(cc4)O)O)O)c5cc(=O)c6c(cc(cc6o5)O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:5
H bond acceptor:10
XLogP3:6.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
BILOBETIN.cml
Quick Release
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