CID 171121097
Sebiferumnin l
Structural Information
- Molecular Formula
- C20H28O4
- SMILES
- C[C@@]12CC(=O)[C@H](C([C@H]1CC[C@]34[C@H]2C[C@H](CC3=O)C(=C)[C@@H]4O)(C)C)O
- InChI
- InChI=1S/C20H28O4/c1-10-11-7-14-19(4)9-12(21)17(24)18(2,3)13(19)5-6-20(14,16(10)23)15(22)8-11/h11,13-14,16-17,23-24H,1,5-9H2,2-4H3/t11-,13-,14+,16+,17-,19-,20+/m1/s1
- InChIKey
- ZFHYMONQRAXFJF-XCBBIKKWSA-N
- Compound name
- (1R,4S,6S,9R,10S,12R,15S)-6,15-dihydroxy-5,5,9-trimethyl-16-methylidenetetracyclo[10.2.2.01,10.04,9]hexadecane-7,14-dione
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 333.20604 | 177.1 |
[M+Na]+ | 355.18798 | 182.5 |
[M-H]- | 331.19148 | 173.8 |
[M+NH4]+ | 350.23258 | 200.8 |
[M+K]+ | 371.16192 | 176.7 |
[M+H-H2O]+ | 315.19602 | 170.3 |
[M+HCOO]- | 377.19696 | 176.9 |
[M+CH3COO]- | 391.21261 | 184.0 |
[M+Na-2H]- | 353.17343 | 182.0 |
[M]+ | 332.19821 | 174.2 |
[M]- | 332.19931 | 174.2 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.