![((1R*,3R*,5S*,6R*,7S*,8Z*)-5-(2'-Acetoxy-1',5'-dimethyl-4'-hydroxy-hex-5'-en-1'-yl)-2-methylene-8-methylbicyclo[5.3.0]dec-8-en-3,6-diol](/api/spectrum/34GPaBeWb4Y/structure.png?h=300&w=458 "((1R*,3R*,5S*,6R*,7S*,8Z*)-5-(2'-Acetoxy-1',5'-dimethyl-4'-hydroxy-hex-5'-en-1'-yl)-2-methylene-8-methylbicyclo[5.3.0]dec-8-en-3,6-diol")
| SpectraBase Compound ID | KB6NVYj0pth |
|---|---|
| InChI | InChI=1S/C22H34O5/c1-11(2)18(24)10-20(27-15(6)23)14(5)17-9-19(25)13(4)16-8-7-12(3)21(16)22(17)26/h7,14,16-22,24-26H,1,4,8-10H2,2-3,5-6H3/t14?,16-,17-,18?,19+,20?,21+,22+/m0/s1 |
| InChIKey | UZYVQRZIBZHQTF-CAJZRQQTSA-N |
| Mol Weight | 378.5 g/mol |
| Molecular Formula | C22H34O5 |
| Exact Mass | 378.240624 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 34GPaBeWb4Y |
|---|---|
| Name | ((1R*,3R*,5S*,6R*,7S*,8Z*)-5-(2'-Acetoxy-1',5'-dimethyl-4'-hydroxy-hex-5'en-1'-yl)-2-methylene-8-methylbicyclo[5.3.0]dec-8-en-3,6-diol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H34O5 |
| InChI | InChI=1S/C22H34O5/c1-11(2)18(24)10-20(27-15(6)23)14(5)17-9-19(25)13(4)16-8-7-12(3)21(16)22(17)26/h7,14,16-22,24-26H,1,4,8-10H2,2-3,5-6H3/t14?,16-,17-,18?,19+,20?,21+,22+/m0/s1 |
| InChIKey | UZYVQRZIBZHQTF-CAJZRQQTSA-N |
| Molecular Weight | 378.509 g/mol |
| SMILES | OC(CC(C([C@]1([C@]([C@]2([C@](C([C@@](C1)(O)[H])=C)(CC=C2C)[H])[H])(O)[H])[H])C)OC(=O)C)C(=C)C |
| SPLASH | splash10-052f-9400000000-6da69fb0595aacddd078 |
| Source of Spectrum | F-49-579-4 |
| Synonyms | ((1R*,3R*,5S*,6R*,7S*,8Z*)-5-(2'-Acetoxy-1',5'-dimethyl-4'(epi)-hydroxy-hex-5'en-1'-yl)-2-methylene-8-methylbicyclo[5.3.0]dec-8-en-3,6-diol Acetic acid [2-[(3aS,4R,5S,7R,8aR)-4,7-dihydroxy-3-methyl-8-methylene-3a,4,5,6,7,8a-hexahydro-1H-azulen-5-yl]-5-hydroxy-6-methylhept-6-en-3-yl] ester [2-[(3aS,4R,5S,7R,8aR)-4,7-dihydroxy-3-methyl-8-methylidene-3a,4,5,6,7,8a-hexahydro-1H-azulen-5-yl]-5-hydroxy-6-methylhept-6-en-3-yl] acetate [1-[1-[(3aS,4R,5S,7R,8aR)-4,7-dihydroxy-3-methyl-8-methylene-3a,4,5,6,7,8a-hexahydro-1H-azulen-5-yl]ethyl]-3-hydroxy-4-methyl-pent-4-enyl] acetate [2-[(3aS,4R,5S,7R,8aR)-3-methyl-8-methylidene-4,7-bis(oxidanyl)-3a,4,5,6,7,8a-hexahydro-1H-azulen-5-yl]-6-methyl-5-oxidanyl-hept-6-en-3-yl] ethanoate |
| Wiley ID | 1357886 |