SpectraBase Spectrum ID |
9YZxQwULgTk |
Name |
(1S,3R,4S,5S,7R)-4-[(Z)-6'-methoxycarbonylhex-2-enyl]-3-[(E)-3''-hydroxyoct-1-enyl]-2,6-dioxatricyclo[3.3.1.0(3,7)]nonane |
CAS Registry Number |
113668-07-8 |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C23H36O5 |
InChI |
InChI=1S/C23H36O5/c1-3-4-7-10-17(24)13-14-23-19(11-8-5-6-9-12-22(25)26-2)20-15-18(28-23)16-21(23)27-20/h5,8,13-14,17-21,24H,3-4,6-7,9-12,15-16H2,1-2H3/b8-5-,14-13+/t17?,18-,19-,20+,21-,23-/m0/s1 |
InChIKey |
WICSAWHKHQLKFJ-RRJPFFCJSA-N |
Molecular Weight |
392.536 g/mol |
SMILES |
OC(\C=C\[C@]12[C@]3(O[C@@]([C@@]2(C\C=C/CCCC(=O)OC)[H])(C[C@](O1)(C3)[H])[H])[H])CCCCC |
SPLASH |
splash10-0uk9-0095000000-28e017145f4d663f6f58 |
Source of Spectrum |
KC-1987-1665-32 |
Synonyms |
(1S,3R,4S,5S,7R)-4-[(Z)-6'-methoxycarbonylhex-2-enyl]-3-[(E)-3''-hydroxyoct-1-enyl]-2,6-dioxatricyclo[3.3.1.0(3,7)]nonane
methyl (5Z)-7-{(1S,3R,4S,5S,7R)-3-[(1E)-3-hydroxy-1-octenyl]-2,6-dioxatricyclo[3.3.1.0(3,7)]non-4-yl}-5-heptenoate |
Wiley ID |
1365920 |