Absinthin
precursor
Showing entry for Absinthin
Identification
- PhytoHub ID
- PHUB000099
- Name
- Absinthin
- Synonyms
- Absynthin
- CAS Number
- Not Available
- Average Mass
- 496.644
- Monoisotopic Mass
- 496.282489008
- Chemical Formula
- C30H40O6
- IUPAC Name
- Not Available
- InChI Key
- PZHWYURJZAPXAN-JJLFJVKSSA-N
- InChI Identifier
InChI=1S/C30H40O6/c1-12-11-18-20-21(30(12)24(18)29(6,34)10-8-17-14(3)27(32)36-25(17)30)15(4)19-22(20)28(5,33)9-7-16-13(2)26(31)35-23(16)19/h11,13-14,16-18,20-25,33-34H,7-10H2,1-6H3/t13-,14-,16?,17?,18+,20?,21?,22?,23?,24?,25?,28-,29-,30+/m0/s1
- SMILES
C[C@H]1C2CC[C@](C)(O)C3C4[C@H]5C=C(C)[C@@]6(C7OC(=O)[C@@H](C)C7CC[C@](C)(O)C56)C4C(C)=C3C2OC1=O
- Structure
Calculated Properties
- Solubility (ALOGPS)
- Not Available
- LogS (ALOGPS)
- Not Available
- LogP (ALOGPS)
- Not Available
- Hydrogen Acceptors
- Not Available
- Hydrogen Donors
- Not Available
- Rotatable Bond Count
- Not Available
- Polar Surface Area
- Not Available
- Refractivity
- Not Available
- Polarizability
- Not Available
- Formal Charge
- Not Available
- Physiological Charge
- Not Available
- pKa (strongest basic)
- Not Available
- pKa (strongest acidic)
- Not Available
Taxonomy
- Family
- Terpenoids
- Class
- Sesquiterpenoids
- Sub-class
- Not Available
Spectra
No spectra information available
Food Sources
| Name | Group | |||
|---|---|---|---|---|
| Absinthe | Beverages, Alcoholic | Publications | Show | |
| Vermouth | Beverages, Alcoholic | Publications | Show |
Metabolism
No metabolism information available
Absinthin