SpectraBase Spectrum ID |
AEVpPmQ8Hja |
Name |
Undecitol, 1,2,6,8,9-pentadeoxy-3,7-bis-O-[(4-methoxyphenyl)methyl]-6,8-dimethyl-4-C-methyl-4,5-O-(1-methylethylidene)-10-C-phenyl- |
Alternate Name(s) |
(2RS,4R,5S,6S,7R,8R,9R)-1,2-dihydroxy-7,8-isopropylidenedioxy-5,9-bis(4-methoxybenzyloxy)-4,6,8-trimethyl-2-phenylundecane
3,4,6,10,11-pentadeoxy-5,9-bis-O-(4-methoxybenzyl)-4,6-dimethyl-8-C-methyl-7,8-O-(1-methylethylidene)-2-C-phenyl-D-erythro-L-galacto-undecitol |
CAS Registry Number |
96918-77-3 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C39H54O8 |
InChI |
InChI=1S/C39H54O8/c1-9-34(44-24-29-15-19-32(42-7)20-16-29)38(6)36(46-37(4,5)47-38)28(3)35(45-25-30-17-21-33(43-8)22-18-30)27(2)23-39(41,26-40)31-13-11-10-12-14-31/h10-22,27-28,34-36,40-41H,9,23-26H2,1-8H3/t27-,28+,34-,35+,36-,38-,39?/m1/s1 |
InChIKey |
MZOIBPLUJXDYTL-MSVBEZMHSA-N |
Molecular Weight |
650.853 g/mol |
SMILES |
OC(CO)(C[C@]([C@@]([C@@]([C@@]1([C@](OC(C)(C)O1)([C@](OCc1ccc(cc1)OC)(CC)[H])C)[H])(C)[H])(OCc1ccc(cc1)OC)[H])(C)[H])c1ccccc1 |
SPLASH |
splash10-00di-0900000000-43d5c70c45067970771c |
Source of Spectrum |
KC-1985-32-20 |
Wiley ID |
1413136 |