Account 7-(1,2,3,12,13,14,15-heptahydroxy-5,10-dioxo-5,7,8,10-tetrahydro-4,7-methanodibenzo[f,h][1,4]dioxecin-8-yl)-1,2,3,13,14,15-hexahydroxy-5,11-dioxo-5,8,9,11-tetrahydro-7H-dibenzo[g,i][1,5]dioxacycloundecin-8-yl 3,4,5-trihydroxybenzoate
- Catalog No. :
- ACQGZM429
- CAS No. :
- 79786-01-9
- Molecular Formula :
- C41H28O26
- Molecular Weight :
- 936.65
IUPAC Name:7-(1,2,3,12,13,14,15-heptahydroxy-5,10-dioxo-5,7,8,10-tetrahydro-4,7-methanodibenzo[f,h][1,4]dioxecin-8-yl)-1,2,3,13,14,15-hexahydroxy-5,11-dioxo-5,8,9,11-tetrahydro-7H-dibenzo[g,i][1,5]dioxacycloundecin-8-yl 3,4,5-trihydroxybenzoate
![7-(1,2,3,12,13,14,15-heptahydroxy-5,10-dioxo-5,7,8,10-tetrahydro-4,7-methanodibenzo[f,h][1,4]dioxecin-8-yl)-1,2,3,13,14,15-hexahydroxy-5,11-dioxo-5,8,9,11-tetrahydro-7H-dibenzo[g,i][1,5]dioxacycloundecin-8-yl 3,4,5-trihydroxybenzoate structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | 7-(1,2,3,12,13,14,15-heptahydroxy-5,10-dioxo-5,7,8,10-tetrahydro-4,7-methanodibenzo[f,h][1,4]dioxecin-8-yl)-1,2,3,13,14,15-hexahydroxy-5,11-dioxo-5,8,9,11-tetrahydro-7H-dibenzo[g,i][1,5]dioxacycloundecin-8-yl 3,4,5-trihydroxybenzoate |
|---|---|
| IUPAC Name | 7-(1,2,3,12,13,14,15-heptahydroxy-5,10-dioxo-5,7,8,10-tetrahydro-4,7-methanodibenzo[f,h][1,4]dioxecin-8-yl)-1,2,3,13,14,15-hexahydroxy-5,11-dioxo-5,8,9,11-tetrahydro-7H-dibenzo[g,i][1,5]dioxacycloundecin-8-yl 3,4,5-trihydroxybenzoate |
| Molecular Formula | C41H28O26 |
| Molecular Weight | 936.65 |
| SMILES | O=C(OC1COC(=O)C2=CC(O)=C(O)C(O)=C2C2=C(O)C(O)=C(O)C=C2C(=O)OC1C1OC(=O)C2=CC(O)=C(O)C(O)=C2C2=C3C(=O)OC1C(O)C3=C(O)C(O)=C2O)C1=CC(O)=C(O)C(O)=C1 |
| InChI Key | MMQXBTULXAEKQE-UHFFFAOYSA-N |
| Synonym | CASUARININ;Neovescalin, 11-de(6-carboxy-2,3,4-trihydroxyphenyl)-, cyclic 16,18-(4,4',5,5',6,6'-hexahydroxy(1,1-biphenyl)-2,2'-dicarboxylate) 17-(3,4,5-trihydroxybenzoate), (15beta)-;[(15β)-11-De(6-carboxy-2,3,4-trihydroxyphenyl)-16,18-dideoxy-16,18-[(4,4',5,5',6,6'-hexahydroxybiphenyl-2,2'-diyl)bis(carbonyloxy)]neovescalin]17-(3,4,5-trihydroxybenzoate) |
| CAS No. | 79786-01-9 |
Synthetic Route by SureRoute
2. ACQGZM429 Molecular Building Block Synthetic Route
4-(3-carboxy-1-((14,15,16,24,25,26,55-heptahydroxy-3,8-dioxo-56-((3,4,5-trihydroxybenzoyl)oxy)-53,54,55,56-tetrahydro-52H-4,7-dioxa-5(4,2)-pyrana-1,2(1,2)-dibenzenacyclooctaphane-53-yl)oxy)-1-oxopropan-2-yl)-5,6,7-trihydroxy-1-oxoisochromane-3-carboxylic acid
Norbergenin
3,8,10-trihydroxy-2-(hydroxymethyl)-9-methoxy-6-oxo-2,3,4,4a,6,10b-hexahydropyrano[3,2-c]isochromen-4-yl 3,4,5-trihydroxybenzoate