Account (3R,5bS,7aS,13bS,13cR,15aS)-5b-hydroxy-2,2,13b,13c-tetramethyl-9-(2-methylbut-3-en-2-yl)-2,3,5b,6,7,7a,8,13,13b,13c,14,15-dodecahydro-4H-3,15a-epoxyoxepino[2'',3'':5',6']benzo[1',2':6,7]indeno[1,2-b]indol-4-one
- Catalog No. :
- ACYNOZ599
- CAS No. :
- 70553-75-2
- Molecular Formula :
- C32H39NO4
- Molecular Weight :
- 501.67
IUPAC Name:(3R,5bS,7aS,13bS,13cR,15aS)-5b-hydroxy-2,2,13b,13c-tetramethyl-9-(2-methylbut-3-en-2-yl)-2,3,5b,6,7,7a,8,13,13b,13c,14,15-dodecahydro-4H-3,15a-epoxyoxepino[2'',3'':5',6']benzo[1',2':6,7]indeno[1,2-b]indol-4-one
![(3R,5bS,7aS,13bS,13cR,15aS)-5b-hydroxy-2,2,13b,13c-tetramethyl-9-(2-methylbut-3-en-2-yl)-2,3,5b,6,7,7a,8,13,13b,13c,14,15-dodecahydro-4H-3,15a-epoxyoxepino[2'',3'':5',6']benzo[1',2':6,7]indeno[1,2-b]indol-4-one structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | (3R,5bS,7aS,13bS,13cR,15aS)-5b-hydroxy-2,2,13b,13c-tetramethyl-9-(2-methylbut-3-en-2-yl)-2,3,5b,6,7,7a,8,13,13b,13c,14,15-dodecahydro-4H-3,15a-epoxyoxepino[2'',3'':5',6']benzo[1',2':6,7]indeno[1,2-b]indol-4-one |
|---|---|
| IUPAC Name | (3R,5bS,7aS,13bS,13cR,15aS)-5b-hydroxy-2,2,13b,13c-tetramethyl-9-(2-methylbut-3-en-2-yl)-2,3,5b,6,7,7a,8,13,13b,13c,14,15-dodecahydro-4H-3,15a-epoxyoxepino[2'',3'':5',6']benzo[1',2':6,7]indeno[1,2-b]indol-4-one |
| Molecular Formula | C32H39NO4 |
| Molecular Weight | 501.67 |
| SMILES | C=CC(C)(C)C1=C2C3=C(NC2=CC=C1)[C@@]1(C)[C@@H](CC[C@@]2(O)C4=CC(=O)[C@@H]5O[C@@]4(CC[C@@]21C)OC5(C)C)C3 |
| InChI Key | YVDJBQQJIDPRKP-SLUQHKSNSA-N |
| Synonym | aflatrem;9-(1,1-Dimethyl-2-propenyl)-2,3,5b,6,7,7aα,8,13,13b,13c,14,15-dodecahydro-5bβ-hydroxy-2,2,13bβ,13cα-tetramethyl-4H-3β,15aβ-epoxy-1-benzoxepino[6',7':6,7]indeno[1,2-b]indol-4-one;4H-3,15a-Epoxy-1-benzoxepino[6',7':6,7]indeno[1,2-b]indol-4-one, 9-(1,1-dimethyl-2-propen-1-yl)-2,3,5b,6,7,7a,8,13,13b,13c,14,15-dodecahydro-5b-hydroxy-2,2,13b,13c-tetramethyl-, (3R,5bS,7aS,13bS,13cR,15aS)- |
| CAS No. | 70553-75-2 |
Synthetic Route by SureRoute
2. ACYNOZ599 Molecular Building Block Synthetic Route
(3R,5bS,7aS,13bS,13cR,15aS)-5b-hydroxy-2,2,13b,13c-tetramethyl-10-(2-methylbut-3-en-2-yl)-2,3,5b,6,7,7a,8,13,13b,13c,14,15-dodecahydro-4H-3,15a-epoxyoxepino[2'',3'':5',6']benzo[1',2':6,7]indeno[1,2-b]indol-4-one
(3R,5bS,7aS,13bS,13cR,15aS)-5b-hydroxy-2,2,13b,13c-tetramethyl-2,3,5b,6,7,7a,8,13,13b,13c,14,15-dodecahydro-4H-3,15a-epoxyoxepino[2'',3'':5',6']benzo[1',2':6,7]indeno[1,2-b]indol-4-one
4b-hydroxy-2-(2-hydroxypropan-2-yl)-12b,12c-dimethyl-5,6,6a,7,12,12b,12c,13,14,14a-decahydro-2H-chromeno[5',6':6,7]indeno[1,2-b]indol-3(4bH)-one