72691-29-3
1,2,3,4-TETRA-O-ACETYL-6-O-(2,3,4,6-TETRA-O-ACETYL-ALPHA-D-MANNOPYRANOSYL)-D-MANNOPYRANNOSE
Name1,2,3,4-TETRA-O-ACETYL-6-O-(2,3,4,6-TETRA-O-ACETYL-ALPHA-D-MANNOPYRANOSYL)-D-MANNOPYRANNOSE
1Identification
【Name】
1,2,3,4-TETRA-O-ACETYL-6-O-(2,3,4,6-TETRA-O-ACETYL-ALPHA-D-MANNOPYRANOSYL)-D-MANNOPYRANNOSE
【CAS】
【MDL】
MFCD04039380
【English Synonyms】
【Formula】
C28 H38 O19
【MolWeight】
678.589
【Inchi】
InChI=1S/C28H38O19/c1-11(29)37-9-19-21(39-12(2)30)23(41-14(4)32)25(43-16(6)34)27(46-19)38-10-20-22(40-13(3)31)24(42-15(5)33)26(44-17(7)35)28(47-20)45-18(8)36/h19-28H,9-10H2,1-8H3/t19-,20-,21-,22-,23+,24+,25+,26+,27+,28?/m1/s1
【InChIKey】
InChIKey=GNTLGGDVHFXGLI-RHRLCGFESA-N
【SMILES】
CC(=O)OC[C@@H]1[C@H]([C@@H]([C@@H]([C@H](O1)OC[C@@H]2[C@H]([C@@H]([C@@H](C(O2)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C
【MOL File】
1,2,3,4-TETRA-O-ACET….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:19
XLogP3:-1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1,2,3,4-TETRA-O-ACETYL-6-O-(2,3,4,6-TETRA-O-ACETYL-ALPHA-D-MANNOPYRANOSYL)-D-MANNOPYRANNOSE.cml