Netzahualcoyone
methyl 3,10-dihydroxy-2,4a,6,6a,9,14a-hexamethyl-4,11-dioxo-1,3,5,13,14,14b-hexahydropicene-2-carboxylate
Also Known As: Netzahualcoyone|methyl 3,10-dihydroxy-2,4a,6,6a,9,14a-hexamethyl-4,11-dioxo-1,3,5,13,14,14b-hexahydropicene-2-carboxylate|24,25,26,27-Tetranoroleana-1(10),3,5,7,14-pentaen-29-oicacid, 3,21-dihydroxy-9,13,15-trimethyl-2,22-dioxo-, methyl ester, (9b,13a,20a,21b)-|D:A-Friedo-24,26-dinoroleana-1(10),3,5,7,14-pentaen-29-oic acid, 3,21-dihydroxy-15-methyl-2,22-dioxo-, methyl ester, (20alpha,21beta)-|METHYL 3,10-DIHYDROXY-2,4A,6,9,12B,14A-HEXAMETHYL-4,11-DIOXO-1,2,3,4,4A,5,11,12B,13,14,14A,14B-DODECAHYDROPICENE-2-CARBOXYLATE
| Molecular Formula | C30H36O6 |
|---|---|
| Molecular Weight | 492.2512 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 492.2512 |
| Monoisotopic Mass | 492.2512 |
| Heavy Atoms | 36 |
| Complexity | 1290.0 |
Chemical Identifiers
| CAS Number | 87686-36-0 |
|---|---|
| SMILES | CC1=C2C3=CC=C4C(=C(C(=O)C=C4C3(CCC2(C5CC(C(C(=O)C5(C1)C)O)(C)C(=O)OC)C)C)O)C |
| InChIKey | JBKXDADFFNVBTG-UHFFFAOYSA-N |
Product Overview
Netzahualcoyone (CAS 87686-36-0), with molecular formula C30H36O6 and molecular weight 492.2512 g/mol. IUPAC: methyl 3,10-dihydroxy-2,4a,6,6a,9,14a-hexamethyl-4,11-dioxo-1,3,5,13,14,14b-hexahydropicene-2-carboxylate.