| SpectraBase Spectrum ID |
IST98CuQkXH |
| Name |
(1S,3R,5R,6R,7R,8R,9R,12R)-6-[3'-Benzyloxy-2'-methylpropyl]-3-ethoxy-12-isopropyl-9-methyl-2-oxatetracyclo[6.4.0.0(3,7).0(5,9)]dodecan-6-ol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H42O4 |
| InChI |
InChI=1S/C28H42O4/c1-6-31-28-15-22-26(5)13-12-21(18(2)3)24(32-28)23(26)25(28)27(22,29)14-19(4)16-30-17-20-10-8-7-9-11-20/h7-11,18-19,21-25,29H,6,12-17H2,1-5H3/t19?,21-,22-,23+,24+,25+,26+,27+,28-/m1/s1 |
| InChIKey |
NSWBZJCELAUILU-ZEVFOEEGSA-N |
| Molecular Weight |
442.640 g/mol |
| SMILES |
O[C@@]1([C@]2([C@@]3(O[C@@]4([C@@]2([C@](CC[C@@]4(C(C)C)[H])(C)[C@@]1([H])C3)[H])[H])OCC)[H])CC(COCc1ccccc1)C |
| SPLASH |
splash10-0006-9020000000-aaf3f7549a841c5bcfda |
| Source of Spectrum |
AH-125-1006-21 |
| Synonyms |
(1S,2R,3S,4S,6R,8S,9R,12R)-3-[3-(benzyloxy)-2-methylpropyl]-6-ethoxy-9-isopropyl-12-methyl-7-oxatetracyclo[6.4.0.0(2,6).0(4,12)]dodecan-3-ol |
| Wiley ID |
1385486 |
![(1S,3R,5R,6R,7R,8R,9R,12R)-6-[3'-Benzyloxy-2'-methylpropyl]-3-ethoxy-12-isopropyl-9-methyl-2-oxatetracyclo[6.4.0.0(3,7).0(5,9)]dodecan-6-ol](/api/spectrum/IST98CuQkXH/structure.png?h=300&w=458 "(1S,3R,5R,6R,7R,8R,9R,12R)-6-[3'-Benzyloxy-2'-methylpropyl]-3-ethoxy-12-isopropyl-9-methyl-2-oxatetracyclo[6.4.0.0(3,7).0(5,9)]dodecan-6-ol")
