Zoanthenamine
(6S,8S,13S,14R,15S,16R,17R,18R,23R)-16-hydroxy-8,13,17,21-tetramethylspiro[25,26-dioxa-4-azaheptacyclo[14.7.2.16,10.01,15.03,13.04,10.018,23]hexacosa-2,20-diene-14,4'-oxolane]-2',19-dione
Also Known As: Zoanthenamine|(3'R,4aR,5R,6R,6aS,7aS,11S,13S,16bR)-6-Hydroxy-2,5,7a,11-tetramethyl-1,4a,5,6,6a,8,9,11,12,13,14,16b-dodecahydro-4H,7aH,10H-spiro[9a,13-epoxy-6,16a-(epoxymethano)azepino[1,2-a]naphtho[2,1-g]quinoline-7,3'-oxolane]-4,5'-dione|6-Hydroxy-2,5,7a,11-tetramethyl-1,4a,5,6,6a,8,9,11,12,13,14,16b-dodecahydro-4H,7aH,10H-spiro[9a,13-epoxy-6,16a-(epoxymethano)azepino[1,2-a]naphtho[2,1-g]quinoline-7,3'-oxolane]-4,5'-dione
| Molecular Formula | C30H39NO6 |
|---|---|
| Molecular Weight | 509.27774 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 85.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 0 |
| Exact Mass | 509.27774 |
| Monoisotopic Mass | 509.27774 |
| Heavy Atoms | 37 |
| Complexity | 1190.0 |
Chemical Identifiers
| CAS Number | 97877-69-5 |
|---|---|
| SMILES | C[C@H]1C[C@H]2CN3C4=CC56CO[C@@]([C@@H]5[C@@]7([C@@]4(CCC3(C1)O2)C)CC(=O)OC7)([C@@H]([C@H]8[C@H]6CC(=CC8=O)C)C)O |
| InChIKey | ACDRDEOVULSAPQ-NUMHYOOVSA-N |
Product Overview
Zoanthenamine (CAS 97877-69-5), with molecular formula C30H39NO6 and molecular weight 509.27774 g/mol. IUPAC: (6S,8S,13S,14R,15S,16R,17R,18R,23R)-16-hydroxy-8,13,17,21-tetramethylspiro[25,26-dioxa-4-azaheptacyclo[14.7.2.16,10.01,15.03,13.04,10.018,23]hexacosa-2,20-diene-14,4'-oxolane]-2',19-dione.
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