![3a,8,10a-Trihydroxy-5-(hydroxymethyl)-2,10-dimethyl-4,6a,7,8,9,10,10a,10b-octahydrobenzo[e]azulen-3(3ah)-one](/api/spectrum/A658GusaSeK/structure.png?h=300&w=458 "3a,8,10a-Trihydroxy-5-(hydroxymethyl)-2,10-dimethyl-4,6a,7,8,9,10,10a,10b-octahydrobenzo[e]azulen-3(3ah)-one")
| SpectraBase Compound ID | 6TgfwVtHeqv |
|---|---|
| InChI | InChI=1S/C17H24O5/c1-9-3-14-16(21,15(9)20)7-11(8-18)5-12-6-13(19)4-10(2)17(12,14)22/h3,5,10,12-14,18-19,21-22H,4,6-8H2,1-2H3 |
| InChIKey | STBVICLDXDVFGP-UHFFFAOYSA-N |
| Mol Weight | 308.37 g/mol |
| Molecular Formula | C17H24O5 |
| Exact Mass | 308.162374 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | A658GusaSeK |
|---|---|
| Name | 3a,8,10a-Trihydroxy-5-(hydroxymethyl)-2,10-dimethyl-4,6a,7,8,9,10,10a,10b-octahydrobenzo[e]azulen-3(3ah)-one |
| CAS Registry Number | 77573-30-9 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C17H24O5 |
| InChI | InChI=1S/C17H24O5/c1-9-3-14-16(21,15(9)20)7-11(8-18)5-12-6-13(19)4-10(2)17(12,14)22/h3,5,10,12-14,18-19,21-22H,4,6-8H2,1-2H3 |
| InChIKey | STBVICLDXDVFGP-UHFFFAOYSA-N |
| Molecular Weight | 308.374 g/mol |
| SMILES | OC12CC(=CC3C(C(CC(C3)O)C)(C2C=C(C1=O)C)O)CO |
| SPLASH | splash10-052f-9820000000-8e8e628b785e44d43a6b |
| Source of Spectrum | W5-0-0-0 |
| Synonyms | 3a,8,10a-trihydroxy-2,10-dimethyl-5-methylol-6a,7,8,9,10,10b-hexahydro-4H-benz[e]azulen-3-one 3a,8,10a-trihydroxy-5-(hydroxymethyl)-2,10-dimethyl-6a,7,8,9,10,10b-hexahydro-4H-benzo[e]azulen-3-one 5-(hydroxymethyl)-2,10-dimethyl-3a,8,10a-tris(oxidanyl)-6a,7,8,9,10,10b-hexahydro-4H-benzo[e]azulen-3-one Benz[e]azulen-3(3aH)-one, 4,6a,7,8,9,10,10a,10b-octahydro-3a,8,10a-trihydroxy-5-(hydroxymethyl)-2,10-dimethyl-, [3aR-(3a.alpha.,6a.alpha.,8.beta.,10.beta.,10a.beta.,10b.beta.)]- |
| Wiley ID | 1309773 |