名称: compound 10a
IUPAC: [(2R,3R,4S,5R,6S)-5-benzoyloxy-6-[(2R,3R,4S,5R,6R)-5-benzoyloxy-2-(benzoyloxymethyl)-4-[(2S,3S,4R,5R,6S)-6-methyl-3,4,5-tris(phenylmethoxy)oxan-2-yl]oxy-6-(2-trimethylsilylethoxy)oxan-3-yl]oxy-3,4-dihydroxyoxan-2-yl]methyl benzoate
SMILES:
C[C@@H]1O[C@@H](O[C@@H]2[C@@H](OC(=O)c3ccccc3)[C@H](OCC[Si](C)(C)C)O[C@H](COC(=O)c3ccccc3)[C@H]2O[C@@H]2O[C@H](COC(=O)c3ccccc3)[C@H](O)[C@H](O)[C@H]2OC(=O)c2ccccc2)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@@H]1OCc1ccccc1Canonical SMILES:
CC1C(C(C(C(O1)OC2C(C(OC(C2OC(=O)C3=CC=CC=C3)OCC[Si](C)(C)C)COC(=O)C4=CC=CC=C4)OC5C(C(C(C(O5)COC(=O)C6=CC=CC=C6)O)O)OC(=O)C7=CC=CC=C7)OCC8=CC=CC=C8)OCC9=CC=CC=C9)OCC1=CC=CC=C1分子式: C72H78O19Si
分子量: 1275.50
InChIKey: AXVVHPKFQPVIFW-SRQCZYIYSA-N
InChI:
PubChem CID: 53667892 →InChI=1S/C72H78O19Si/c1-47-59(80-42-48-26-12-5-13-27-48)62(81-43-49-28-14-6-15-29-49)64(82-44-50-30-16-7-17-31-50)72(85-47)91-63-60(90-71-61(88-68(77)53-36-22-10-23-37-53)58(74)57(73)55(86-71)45-83-66(75)51-32-18-8-19-33-51)56(46-84-67(76)52-34-20-9-21-35-52)87-70(79-40-41-92(2,3)4)65(63)89-69(78)54-38-24-11-25-39-54/h5-39,47,55-65,70-74H,40-46H2,1-4H3/t47-,55+,56+,57-,58-,59+,60+,61+,62+,63-,64-,65+,70+,71-,72-/m0/s1同義語
SCHEMBL8580357AXVVHPKFQPVIFW-SRQCZYIYSA-N2-(Trimethylsilyl) ethyl 2,6-di-O-benzoyl-3-O-(2,3,4-tri-O-benzyl-alpha-L-fucopyranosyl)-4-O-(2,6-di-O-benzoyl-beta-D-galactopyranosyl)-beta-D-glucopyranoside