For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Gymnastatin C
SpectraBase Compound ID 8at9ddmkY1S
InChI InChI=1S/C24H37Cl2NO6/c1-5-6-7-8-9-14(2)12-15(3)10-11-17(28)27-16-13-24(33-23(16)32-4)21(30)18(25)20(29)19(26)22(24)31/h10-12,14,16,18-19,21-23,30-31H,5-9,13H2,1-4H3,(H,27,28)/b11-10+,15-12+/t14-,16+,18-,19+,21-,22-,23-,24+/m1/s1
InChIKey CFUQAHJWAPYZID-WJKMGIHWSA-N
Mol Weight 506.5 g/mol
Molecular Formula C24H37Cl2NO6
Exact Mass 505.199793 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID L4c54UHk3Ap
Name Gymnastatin C
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H37Cl2NO6
InChI InChI=1S/C24H37Cl2NO6/c1-5-6-7-8-9-14(2)12-15(3)10-11-17(28)27-16-13-24(33-23(16)32-4)21(30)18(25)20(29)19(26)22(24)31/h10-12,14,16,18-19,21-23,30-31H,5-9,13H2,1-4H3,(H,27,28)/b11-10+,15-12+/t14-,16+,18-,19+,21-,22-,23-,24+/m1/s1
InChIKey CFUQAHJWAPYZID-WJKMGIHWSA-N
Molecular Weight 506.467 g/mol
SMILES N([C@@]1([C@@](O[C@]2([C@@]([C@](C([C@]([C@]2(O)[H])(Cl)[H])=O)(Cl)[H])(O)[H])C1)(OC)[H])[H])C(\C=C\C(=C\[C@@](CCCCCC)(C)[H])C)=O
SPLASH splash10-0a6s-6590000000-fe24859a9a2570b3d41a
Source of Spectrum KC-0-3594-3
Synonyms (2E,4E,6R)-N-[(2R,3S,6S,7R,9S,10S)-7,9-dichloro-6,10-dihydroxy-2-methoxy-8-oxo-1-oxaspiro[4.5]dec-3-yl]-4,6-dimethyl-2,4-dodecadienamide
Wiley ID 827014