![(3a,8,10a-Trihydroxy-2,10-dimethyl-3-oxo-3,3a,4,6a,7,8,9,10,10a,10b-decahydrobenzo[e]azulen-5-yl)methyl myristate](/api/spectrum/B3nXy6Pydvc/structure.png?h=300&w=458 "(3a,8,10a-Trihydroxy-2,10-dimethyl-3-oxo-3,3a,4,6a,7,8,9,10,10a,10b-decahydrobenzo[e]azulen-5-yl)methyl myristate")
| SpectraBase Compound ID | aPt9OHh3ve |
|---|---|
| InChI | InChI=1S/C31H50O6/c1-4-5-6-7-8-9-10-11-12-13-14-15-28(33)37-21-24-18-25-19-26(32)17-23(3)31(25,36)27-16-22(2)29(34)30(27,35)20-24/h16,18,23,25-27,32,35-36H,4-15,17,19-21H2,1-3H3 |
| InChIKey | YWGPICUDNRQWLW-UHFFFAOYSA-N |
| Mol Weight | 518.7 g/mol |
| Molecular Formula | C31H50O6 |
| Exact Mass | 518.360739 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | B3nXy6Pydvc |
|---|---|
| Name | (3a,8,10a-Trihydroxy-2,10-dimethyl-3-oxo-3,3a,4,6a,7,8,9,10,10a,10b-decahydrobenzo[e]azulen-5-yl)methyl myristate |
| CAS Registry Number | 77573-28-5 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C31H50O6 |
| InChI | InChI=1S/C31H50O6/c1-4-5-6-7-8-9-10-11-12-13-14-15-28(33)37-21-24-18-25-19-26(32)17-23(3)31(25,36)27-16-22(2)29(34)30(27,35)20-24/h16,18,23,25-27,32,35-36H,4-15,17,19-21H2,1-3H3 |
| InChIKey | YWGPICUDNRQWLW-UHFFFAOYSA-N |
| Molecular Weight | 518.735 g/mol |
| SMILES | OC12CC(=CC3C(C(CC(C3)O)C)(C2C=C(C1=O)C)O)COC(=O)CCCCCCCCCCCCC |
| SPLASH | splash10-052f-9840000000-84a74522c13be5a7d520 |
| Source of Spectrum | W5-0-0-0 |
| Synonyms | (3a,8,10a-trihydroxy-2,10-dimethyl-3-oxo-6a,7,8,9,10,10b-hexahydro-4H-benzo[e]azulen-5-yl)methyl tetradecanoate myristic acid (3a,8,10a-trihydroxy-3-keto-2,10-dimethyl-6a,7,8,9,10,10b-hexahydro-4H-benz[e]azulen-5-yl)methyl ester Tetradecanoic acid (3a,8,10a-trihydroxy-2,10-dimethyl-3-oxo-6a,7,8,9,10,10b-hexahydro-4H-benzo[e]azulen-5-yl)methyl ester Tetradecanoic acid, (3,3a,4,6a,7,8,9,10,10a,10b-decahydro-3a,8,10a-trihydroxy-2,10-dimethyl-3-oxobenz[e]azulen-5-yl)methyl ester, [3aR-(3a.alpha.,6a.alpha.,8.alpha.,10.beta.,10a.beta.,10b.beta.)]- Tetradecanoic acid, (3,3a,4,6a,7,8,9,10,10a,10b-decahydro-3a,8,10a-trihydroxy-2,10-dimethyl-3-oxobenz[e]azulen-5-yl)methyl ester, [3aR-(3a.alpha.,6a.alpha.,8.beta.,10.beta.,10a.beta.,10b.beta.)]- [2,10-dimethyl-3a,8,10a-tris(oxidanyl)-3-oxidanylidene-6a,7,8,9,10,10b-hexahydro-4H-benzo[e]azulen-5-yl]methyl tetradecanoate |
| Wiley ID | 1401754 |