5,13,17-trihydroxy-7,12-dimethyl-9,15-dioxo-2,10,16-trioxatetracyclo[9.7.0.0³,⁸.0¹⁴,¹⁸]octadeca-1(18),3(8),4,6,11,13-hexaene-4-carbaldehyde
Structure Info
- Chemspace ID
- CSSB00020677000 (In-Stock Building Blocks)
- MFCD
- MFCD02113777
- IUPAC Name
- 5,13,17-trihydroxy-7,12-dimethyl-9,15-dioxo-2,10,16-trioxatetracyclo[9.7.0.0³,⁸.0¹⁴,¹⁸]octadeca-1(18),3(8),4,6,11,13-hexaene-4-carbaldehyde
- Mol formula
- C18H12O9
- Mol weight
- 372 Da
- Catalog Number(s)
- 29581, 218770, 571-67-5, AA00EH5B, ACM571675, AG00EH83, AG75307, AGN-PC-0SN51K, AR00EHX3, BD118901, BIA-N1740, BS-18715, CSC020677000, EC00EJDV, FN157372, HY-N10457, ST00EIOV, T71795, TX00EIDR, Y3579071
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.58
- Heavy atoms count
- 27
- Rotatable bond count
- 1
- Number of rings
- 4
- Carbon bond saturation, Fsp3
- 0.166
- Polar surface area (Å)
- 140
- Hydrogen bond acceptors count
- 6
- Hydrogen bond donors count
- 3
![Chemical structure of 5,13,17-trihydroxy-7,12-dimethyl-9,15-dioxo-2,10,16-trioxatetracyclo[9.7.0.0³,⁸.0¹⁴,¹⁸]octadeca-1(18),3(8),4,6,11,13-hexaene-4-carbaldehyde (C18H12O9) - CSSB00020677000](/st/structure/200/f239502adc448f059c88f3dbec7cec40/CC1%253DCC%2528O%2529%253DC%2528C%253DO%2529C2%253DC1C%2528%253DO%2529OC1%253DC%2528C%2529C%2528O%2529%253DC3C%2528%253DO%2529OC%2528O%2529C3%253DC1O2.png "C18H12O9")
- Zoom the structure
- CSSB00020677000
Items Overall 8 items from 8 suppliers
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| 1st Scientific CN | 7 days | China To: | 98 | 1 mg | 499.40 | |
Description: 1,3-Dihydro-1,4,10-trihydroxy-5,8-dimethyl-3,7-dioxo-7H-isobenzofuro[4,5-b][1,4]benzodioxepin-11-carboxaldehyde; CAS: 571-67-5 | ||||||
| 1st Scientific LLC | 7 days | United States To: | 98 | 1 mg | 499.40 | |
Description: 1,3-Dihydro-1,4,10-trihydroxy-5,8-dimethyl-3,7-dioxo-7H-isobenzofuro[4,5-b][1,4]benzodioxepin-11-carboxaldehyde; CAS: 571-67-5 | ||||||
| Angene US | 10 days | United States To: | 95 | 1 mg | 252.00 | |
Description: 1,3-Dihydro-1,4,10-trihydroxy-5,8-dimethyl-3,7-dioxo-7H-isobenzofuro[4,5-b][1,4]benzodioxepin-11-carboxaldehyde; CAS: 571-67-5 | ||||||
| AA BLOCKS | 12 days | United States To: | 95 | 1 mg | 239.80 | |
Description: 1,3-Dihydro-1,4,10-trihydroxy-5,8-dimethyl-3,7-dioxo-7H-isobenzofuro[4,5-b][1,4]benzodioxepin-11-carboxaldehyde; CAS: 571-67-5 | ||||||
| A2B Chem | 12 days | United States To: | 95 | 1 mg | 250.70 | |
Description: Norstictic Acid; CAS: 571-67-5 | ||||||
| Aaron Chemicals LLC | 12 days | United States To: | 98 | 1 mg | 1,085.60 | |
| Accel Scientific, S.L. | 20 days | China To: | 98 | 1 mg | 1,519.10 | |
Description: 1,3-Dihydro-1,4,10-trihydroxy-5,8-dimethyl-3,7-dioxo-7H-isobenzofuro[4,5-b][1,4]benzodioxepin-11-carboxaldehyde; CAS: 571-67-5 | ||||||
| 10X CHEM | TBD | United States To: | 95 | 1 mg | 215.60 | |
Description: 1,3-Dihydro-1,4,10-trihydroxy-5,8-dimethyl-3,7-dioxo-7H-isobenzofuro[4,5-b][1,4]benzodioxepin-11-carboxaldehyde; CAS: 571-67-5 | ||||||
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Substructure Analogs
![Chemical structure of 13,17-dihydroxy-5-methoxy-7,12-dimethyl-9,15-dioxo-2,10,16-trioxatetracyclo[9.7.0.0³,⁸.0¹⁴,¹⁸]octadeca-1(18),3,5,7,11,13-hexaene-4-carbaldehyde - CSSB00020682019](/st/structure/200/594d7c737091c2113e2d7e6aff6bfeba/COC1%253DCC%2528C%2529%253DC2C%2528OC3%253DC4C%2528O%2529OC%2528%253DO%2529C4%253DC%2528O%2529C%2528C%2529%253DC3OC2%253DO%2529%253DC1C%253DO.png)
![Chemical structure of 5,13,17-trihydroxy-12-(hydroxymethyl)-7-methyl-9,15-dioxo-2,10,16-trioxatetracyclo[9.7.0.0³,⁸.0¹⁴,¹⁸]octadeca-1(18),3(8),4,6,11,13-hexaene-4-carbaldehyde - CSSB00161006244](/st/structure/200/e3c946ff9bed8ef67903a6b64b24f566/CC1%253DCC%2528O%2529%253DC%2528C%253DO%2529C2%253DC1C%2528%253DO%2529OC1%253DC%2528CO%2529C%2528O%2529%253DC3C%2528%253DO%2529OC%2528O%2529C3%253DC1O2.png)
![Chemical structure of {4-formyl-5,13,17-trihydroxy-7-methyl-9,15-dioxo-2,10,16-trioxatetracyclo[9.7.0.0³,⁸.0¹⁴,¹⁸]octadeca-1(11),3,5,7,12,14(18)-hexaen-12-yl}methyl acetate - CSSB03437848726](/st/structure/200/f34372c7e5c66b7a57389b73470c9519/CC%2528%253DO%2529OCC1%253DC%2528O%2529C2%253DC%2528C%2528O%2529OC2%253DO%2529C2%253DC1OC%2528%253DO%2529C1%253DC%2528C%2529C%253DC%2528O%2529C%2528C%253DO%2529%253DC1O2.png)
Similarity Analogs
![Chemical structure of 15-formyl-14-hydroxy-6-methoxy-7,12-dimethyl-10-oxo-2,9-dioxatricyclo[9.4.0.0³,⁸]pentadeca-1(15),3,5,7,11,13-hexaene-4-carboxylic acid - CSSB00000129480](/st/structure/200/9f0f1583dedaabbdecc02d709c7fa0ec/COC1%253DCC%2528C%2528O%2529%253DO%2529%253DC2OC3%253DC%2528C%253DO%2529C%2528O%2529%253DCC%2528C%2529%253DC3C%2528%253DO%2529OC2%253DC1C.png)
![Chemical structure of 5,14-dihydroxy-7,12-dimethyl-6-(3-methylbut-2-en-1-yl)-10-oxo-2,9-dioxatricyclo[9.4.0.0³,⁸]pentadeca-1(15),3,5,7,11,13-hexaene-15-carbaldehyde - CSSB14929136819](/st/structure/200/24d10f4f192b595f4b40f3dc4909907e/CC%2528C%2529%253DCCc1c%2528O%2529cc2Oc3c%2528C%253DO%2529c%2528O%2529cc%2528C%2529c3C%2528%253DO%2529Oc2c1C.png)
