Account (3S,5S,8S,9R,10R,13R,14R,17R)-17-((2R,5R,E)-5,6-dimethylhept-3-en-2-yl)-10,13-dimethyl-1,3,4,9,10,11,12,13,14,15,16,17-dodecahydro-2H-5,8-epidioxycyclopenta[a]phenanthren-3-ol
- Catalog No. :
- ACOIOF185
- CAS No. :
- 2061-64-5
- Molecular Formula :
- C28H44O3
- Molecular Weight :
- 428.66
IUPAC Name:(3S,5S,8S,9R,10R,13R,14R,17R)-17-((2R,5R,E)-5,6-dimethylhept-3-en-2-yl)-10,13-dimethyl-1,3,4,9,10,11,12,13,14,15,16,17-dodecahydro-2H-5,8-epidioxycyclopenta[a]phenanthren-3-ol
![(3S,5S,8S,9R,10R,13R,14R,17R)-17-((2R,5R,E)-5,6-dimethylhept-3-en-2-yl)-10,13-dimethyl-1,3,4,9,10,11,12,13,14,15,16,17-dodecahydro-2H-5,8-epidioxycyclopenta[a]phenanthren-3-ol structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | (3S,5S,8S,9R,10R,13R,14R,17R)-17-((2R,5R,E)-5,6-dimethylhept-3-en-2-yl)-10,13-dimethyl-1,3,4,9,10,11,12,13,14,15,16,17-dodecahydro-2H-5,8-epidioxycyclopenta[a]phenanthren-3-ol |
|---|---|
| IUPAC Name | (3S,5S,8S,9R,10R,13R,14R,17R)-17-((2R,5R,E)-5,6-dimethylhept-3-en-2-yl)-10,13-dimethyl-1,3,4,9,10,11,12,13,14,15,16,17-dodecahydro-2H-5,8-epidioxycyclopenta[a]phenanthren-3-ol |
| Molecular Formula | C28H44O3 |
| Molecular Weight | 428.66 |
| SMILES | CC(C)[C@@H](C)/C=C/[C@@H](C)[C@H]1CC[C@@H]2[C@]1(C)CC[C@H]1[C@]23C=C[C@]2(C[C@@H](O)CC[C@]12C)OO3 |
| InChI Key | VXOZCESVZIRHCJ-KGHQQZOUSA-N |
| Synonym | Ergosterol peroxide;(22E)-5α,8α-Epidioxy-5α-ergosta-6,22-dien-3β-ol;(22E)-5α,8α-Epidioxyergosta-6,22-diene-3β-ol;Ergosterol 5α,8α-epidioxide;Ergosterol endoperoxide;Peroxyergosterol;ergosterol-5,8-peroxide;Ergosta-6,22-dien-3-ol,5,8-epidioxy-, (3b,5a,8a,22E)- |
| CAS No. | 2061-64-5 |
Synthetic Route by SureRoute
2. ACOIOF185 Molecular Building Block Synthetic Route
(4aS,6aS,6bR,8aR,10R,11R,12aS,12bR,14aS,14bS)-2,2,6b,9,9,12a,14a-heptamethyl-1,2,3,4,6b,7,8,8a,9,10,11,12,12a,12b,13,14,14a,14b-octadecahydro-4a,6a-epidioxypicene-10,11-diol
1-isopropyl-4-methyl-2,3-dioxabicyclo[2.2.2]oct-5-ene
(3S,5R,8R,10R,13R,14R,17R)-17-((2R,5R)-5,6-dimethylhept-3-en-2-yl)-10,13-dimethyl-1,3,4,10,12,13,14,15,16,17-decahydro-2H-5,8-epidioxycyclopenta[a]phenanthren-3-ol