| SpectraBase Compound ID | Ef5ftgLa3eR |
|---|---|
| InChI | InChI=1S/C27H40O6/c1-14(7-8-21(32)33)15-11-20(31)27(6)23-16(28)12-18-24(2,3)19(30)9-10-25(18,4)22(23)17(29)13-26(15,27)5/h14-16,18-19,28,30H,7-13H2,1-6H3,(H,32,33)/t14-,15?,16+,18+,19+,25+,26-,27+/m1/s1 |
| InChIKey | YBGBNHHXOJXFNM-OOOBFOHKSA-N |
| Mol Weight | 460.6 g/mol |
| Molecular Formula | C27H40O6 |
| Exact Mass | 460.282489 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | B0svKcPC3X6 |
|---|---|
| Name | Lucidenic acid N |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H40O6 |
| InChI | InChI=1S/C27H40O6/c1-14(7-8-21(32)33)15-11-20(31)27(6)23-16(28)12-18-24(2,3)19(30)9-10-25(18,4)22(23)17(29)13-26(15,27)5/h14-16,18-19,28,30H,7-13H2,1-6H3,(H,32,33)/t14-,15?,16+,18+,19+,25+,26-,27+/m1/s1 |
| InChIKey | YBGBNHHXOJXFNM-OOOBFOHKSA-N |
| Molecular Weight | 460.611 g/mol |
| SMILES | O[C@]1(C[C@]2(C([C@](CC[C@@]2(C2=C1[C@]1([C@@](C([C@@](CCC(=O)O)(C)[H])CC1=O)(CC2=O)C)C)C)(O)[H])(C)C)[H])[H] |
| SPLASH | splash10-01q9-2008900000-87cbd568fa60f80f212f |
| Source of Spectrum | G4-64-1122-1 |
| Synonyms | (3beta,5alpha,7beta)-3,7-dihydroxy-4,4,14-trimethyl-11,15-dioxochol-8-en-24-oic acid (4R)-4-[(3S,5R,7S,10S,13R,14R,17R)-3,7-dihydroxy-11,15-diketo-4,4,10,13,14-pentamethyl-2,3,5,6,7,12,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]valeric acid (4R)-4-[(3S,5R,7S,10S,13R,14R,17R)-3,7-dihydroxy-4,4,10,13,14-pentamethyl-11,15-dioxo-2,3,5,6,7,12,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid (4R)-4-[(3S,5R,7S,10S,13R,14R,17R)-4,4,10,13,14-pentamethyl-3,7-bis(oxidanyl)-11,15-bis(oxidanylidene)-2,3,5,6,7,12,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid |
| Wiley ID | 1609180 |