Account (3S,3AR,5R,7S,7aS,Z)-1-ethylidene-7-isopropyl-3-((2-methylbutanoyl)oxy)-4-methylene-2-oxooctahydro-1H-inden-5-yl (E)-3-methylpent-2-enoate
- Catalog No. :
- ACPKGJ867
- CAS No. :
- 80514-14-3
- Molecular Formula :
- C26H38O5
- Molecular Weight :
- 430.58
IUPAC Name:Anti-inflammatory agent 69
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Product Information
| Product Name | (3S,3AR,5R,7S,7aS,Z)-1-ethylidene-7-isopropyl-3-((2-methylbutanoyl)oxy)-4-methylene-2-oxooctahydro-1H-inden-5-yl (E)-3-methylpent-2-enoate |
|---|---|
| IUPAC Name | Anti-inflammatory agent 69 |
| Molecular Formula | C26H38O5 |
| Molecular Weight | 430.58 |
| SMILES | CC/C(C)=C/C(O[C@H](C[C@@H](C(C)C)[C@]/12[H])C([C@]2([H])[C@H](OC(C(C)CC)=O)C(C1=C/C)=O)=C)=O |
| InChI Key | XTQQLVJPORCMAK-NMNXYZJCSA-N |
| Synonym | 7beta-(3-Ethyl-cis-crotonoyloxy)-1alpha-(2-methylbutyryloxy)-3,14-dehydro-Z-notonipetranone;7β-(3-Ethyl-cis-crotonoyloxy)-1α-(2-methylbutyryloxy)-3,14-dehydro-Z-notonipetranone;7β-[3'-Ethylcrotonoyloxy]-1α-[2'-methylbutyryloxy]-314-dehydro-Z-notonipetranone;2-Pentenoic acid, 3-methyl-, (1Z,3S,3aR,5R,7S,7aS)-1-ethylideneoctahydro-4-methylene-7-(1-methylethyl)-3-(2-methyl-1-oxobutoxy)-2-oxo-1H-inden-5-yl ester, (2E)-;7β-(3-Ethyl-cis-crotonoyloxy)-1α-(2-methylbutyryloxy)-3,14-dehydro-Z-notonipetranone |
| CAS No. | 80514-14-3 |
Synthetic Route by SureRoute
2. ACPKGJ867 Molecular Building Block Synthetic Route
methyl (Z)-2-((1aR,1bS,2R,4aR,4bS,8aS,9aS,10aR,10bS,10cS,11bS)-2-hydroxy-1b,7,10b-trimethyl-9-methylene-3,6-dioxo-1a,1b,2,3,4a,6,8,8a,9,9a,10,10a,10b,10c,11,11b-hexadecahydrocyclopropa[4',5']cyclopenta[1',2':7,8]cyclopropa[4,5]acephenanthryleno[10a,10-b]furan-4(1H)-ylidene)propanoate
(1aR,2Z,4aR,6R,7S,7aS,8Z,10R,11aS)-4a-acetoxy-7-hydroxy-1,1,3,6,9-pentamethyl-4-oxo-1a,4,4a,5,6,7,7a,10,11,11a-decahydro-1H-cyclopenta[a]cyclopropa[f][11]annulen-10-yl (2E,4E)-octa-2,4-dienoate
Xanthumin