Account Gambogoic acid B
- Catalog No. :
- ACWGGJ560
- CAS No. :
- 887923-50-4
- Molecular Formula :
- C40H50O9
- Molecular Weight :
- 674.83
IUPAC Name:(Z)-4-((1S,3aR,5S,6S,6aS,11R,14aS)-6-ethoxy-8-hydroxy-2,2,11-trimethyl-13-(3-methylbut-2-en-1-yl)-11-(4-methylpent-3-en-1-yl)-4,7-dioxo-1,2,5,6,6a,7-hexahydro-11H-1,5-methanofuro[3,2-g]pyrano[3,2-b]xanthen-3a(4H)-yl)-2-methylbut-2-enoic acid
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Product Information
| Product Name | Gambogoic acid B |
|---|---|
| IUPAC Name | (Z)-4-((1S,3aR,5S,6S,6aS,11R,14aS)-6-ethoxy-8-hydroxy-2,2,11-trimethyl-13-(3-methylbut-2-en-1-yl)-11-(4-methylpent-3-en-1-yl)-4,7-dioxo-1,2,5,6,6a,7-hexahydro-11H-1,5-methanofuro[3,2-g]pyrano[3,2-b]xanthen-3a(4H)-yl)-2-methylbut-2-enoic acid |
| Molecular Formula | C40H50O9 |
| Molecular Weight | 674.83 |
| SMILES | CCO[C@H]1[C@@H]2C[C@H]3C(C)(C)O[C@@](C/C=C(/C)C(=O)O)(C2=O)[C@]32OC3=C(C(=O)[C@@H]12)C(O)=C1C=C[C@@](C)(CCC=C(C)C)OC1=C3CC=C(C)C |
| InChI Key | WMAGOAMNTBBBCL-MXHSWORTSA-N |
| Synonym | Gambogoic acid B;2-Butenoic acid, 4-[(1R,3aS,5S,6S,6aS,11R,14aS)-6-ethoxy-3a,4,5,6,6a,7-hexahydro-8-hydroxy-3,3,11-trimethyl-13-(3-methyl-2-buten-1-yl)-11-(4-methyl-3-penten-1-yl)-7,15-dioxo-1,5-methano-1H,3H,11H-furo[3,4-g]pyrano[3,2-b]xanthen-1-yl]-2-methyl-, (2Z)- |
| CAS No. | 887923-50-4 |
Synthetic Route by SureRoute
2. ACWGGJ560 Molecular Building Block Synthetic Route
9S-10alpha-Hydroxyepigambogic acid(C2-S)
(Z)-4-((5S,12aS)-9-((E)-3,7-dimethylocta-2,6-dien-1-yl)-8,10-dihydroxy-6-methoxy-2,2-dimethyl-11-(3-methylbut-2-en-1-yl)-4,7-dioxo-1,2,5,6,6a,7-hexahydro-1,5-methanofuro[2,3-d]xanthen-3a(4H)-yl)-2-methylbut-2-enoic acid
(Z)-4-((1S,3aR,5S,11R,14aS)-8-Hydroxy-2,2,11-trimethyl-13-(3-methylbut-2-en-1-yl)-11-(4-methylpent-3-en-1-yl)-4,7-dioxo-1,2,5,7-tetrahydro-11H-1,5-methanofuro[3,2-g]pyrano[3,2-b]xanthen-3a(4H)-yl)-2-methylbut-2-enoic acid