| SpectraBase Compound ID | DD04RmSafU0 |
|---|---|
| InChI | InChI=1S/C30H48O3/c1-19(18-31)9-8-10-20(2)21-11-16-30(7)26-22(12-15-29(21,30)6)28(5)14-13-25(33)27(3,4)24(28)17-23(26)32/h9,20-21,24-25,31,33H,8,10-18H2,1-7H3/b19-9+/t20-,21-,24+,25+,28-,29-,30+/m1/s1 |
| InChIKey | AZPOACUDFJKUHJ-GPEQXWBKSA-N |
| Mol Weight | 456.7 g/mol |
| Molecular Formula | C30H48O3 |
| Exact Mass | 456.360345 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BDtLBrOAqgG |
|---|---|
| Name | Lucidadiol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H48O3 |
| InChI | InChI=1S/C30H48O3/c1-19(18-31)9-8-10-20(2)21-11-16-30(7)26-22(12-15-29(21,30)6)28(5)14-13-25(33)27(3,4)24(28)17-23(26)32/h9,20-21,24-25,31,33H,8,10-18H2,1-7H3/b19-9+/t20-,21-,24+,25+,28-,29-,30+/m1/s1 |
| InChIKey | AZPOACUDFJKUHJ-GPEQXWBKSA-N |
| Molecular Weight | 456.711 g/mol |
| SMILES | O[C@]1(CC[C@@]2(C3=C([C@]4([C@@]([C@@]([C@@](CC\C=C\(CO)C)(C)[H])(CC4)[H])(CC3)C)C)C(C[C@]2(C1(C)C)[H])=O)C)[H] |
| SPLASH | splash10-004i-0001900000-47ea5480374ab2ad302a |
| Source of Spectrum | G4-62-1701-1 |
| Synonyms | (3S,5R,10S,13R,14R,17R)-3-hydroxy-17-[(E,1R)-6-hydroxy-1,5-dimethyl-hex-4-enyl]-4,4,10,13,14-pentamethyl-1,2,3,5,6,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-7-one (3S,5R,10S,13R,14R,17R)-3-hydroxy-17-[(E,2R)-7-hydroxy-6-methylhept-5-en-2-yl]-4,4,10,13,14-pentamethyl-1,2,3,5,6,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-7-one (3S,5R,10S,13R,14R,17R)-4,4,10,13,14-pentamethyl-17-[(E,2R)-6-methyl-7-oxidanyl-hept-5-en-2-yl]-3-oxidanyl-1,2,3,5,6,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-7-one |
| Wiley ID | 1608170 |