TPCN01790
![[object Object]](../../static/browser_molecular_png/TPCN01790.png)
| Name | (2E,8E)-Deca-2,8-diene-4,6-diyne-1,10-diol-1-O-??-D-apiofuranosyl-(1??6)-??-D-glucopyranoside |
| Molecular Formula | C21H30O11 |
| Molecular Weight | 458.46 |
| CAS Registry Number | 1932660-20-2 |
| SMILES | OCCCC#CC#CC=CCOC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O |
| Classify | Sesquiterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Asteraceae | Atractylodes lancea | Subterraneous stems | 0.000116% | J Nat Prod 79(6): 1567-1575.(2016) | 10.1021/acs.jnatprod.6b00066 |
Properties
| HBA | 11 | HBD | 7 |
| HeavyAtoms | 32 | AlogP | -3.40 |
| TPSA | 178.53 | RotatableBonds | 9 |
| FractionCSP3 | 0.71 | Rings | 2 |
| AromaticRings | 0 | AliphaticRings | 2 |