55533-52-3
MYCOPHENOLIC ACID PHENOLIC BETA-D-GLUCOSIDE
NameMYCOPHENOLIC ACID PHENOLIC BETA-D-GLUCOSIDE
1Identification
【Name】
MYCOPHENOLIC ACID PHENOLIC BETA-D-GLUCOSIDE
【CAS】
【MDL】
MFCD18252523
【English Synonyms】
【Formula】
C23 H30 O11
【MolWeight】
482.479
【Inchi】
InChI=1S/C23H30O11/c1-10(5-4-6-15(25)26)7-12-20(31-3)11(2)13-9-32-22(30)16(13)21(12)34-23-19(29)18(28)17(27)14(8-24)33-23/h5,14,17-19,23-24,27-29H,4,6-9H2,1-3H3,(H,25,26)/b10-5+/t14-,17-,18+,19-,23+/m1/s1
【InChIKey】
InChIKey=BFASGSSIFULNPV-QKGVKKCRSA-N
【SMILES】
Cc1c2c(c(c(c1OC)C/C(=C/CCC(=O)O)/C)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)C(=O)OC2
【MOL File】
MYCOPHENOLIC ACID PH….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:5
H bond acceptor:11
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
MYCOPHENOLIC ACID PHENOLIC BETA-D-GLUCOSIDE.cml