517-44-2
SENNIDINE B
Name
SENNIDINE B
Formula
C30 H18 O10
MolWeight
538.462
1Identification
【Name】
SENNIDINE B
【CAS】
【MDL】
MFCD00198029
【English Synonyms】
【Formula】
C30 H18 O10
【MolWeight】
538.462
【Inchi】
InChI=1S/C30H18O10/c31-17-5-1-3-13-21(15-7-11(29(37)38)9-19(33)25(15)27(35)23(13)17)22-14-4-2-6-18(32)24(14)28(36)26-16(22)8-12(30(39)40)10-20(26)34/h1-10,21-22,31-34H,(H,37,38)(H,39,40)/t21-,22+
【InChIKey】
InChIKey=JPMRHWLJLNKRTJ-SZPZYZBQSA-N
【SMILES】
c1cc2c(c(c1)O)C(=O)c3c(cc(cc3O)C(=O)O)[C@@H]2[C@H]4c5cccc(c5C(=O)c6c4cc(cc6O)C(=O)O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:6
H bond acceptor:10
XLogP3:7.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
SENNIDINE B.cml
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