CID 13969079
Ganoderic acid me
Structural Information
- Molecular Formula
- C34H50O6
- SMILES
- CC(CC/C=C(\C)/C(=O)O)C1CC(C2(C1(CC=C3C2=CCC4C3(CCC(C4(C)C)OC(=O)C)C)C)C)OC(=O)C
- InChI
- InChI=1S/C34H50O6/c1-20(11-10-12-21(2)30(37)38)26-19-29(40-23(4)36)34(9)25-13-14-27-31(5,6)28(39-22(3)35)16-17-32(27,7)24(25)15-18-33(26,34)8/h12-13,15,20,26-29H,10-11,14,16-19H2,1-9H3,(H,37,38)/b21-12+
- InChIKey
- OTUZGGSAOMCYNC-CIAFOILYSA-N
- Compound name
- (E)-6-(3,15-diacetyloxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-methylhept-2-enoic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 555.36798 | 232.2 |
[M+Na]+ | 577.34992 | 234.8 |
[M-H]- | 553.35342 | 233.5 |
[M+NH4]+ | 572.39452 | 248.6 |
[M+K]+ | 593.32386 | 231.4 |
[M+H-H2O]+ | 537.35796 | 228.5 |
[M+HCOO]- | 599.35890 | 233.9 |
[M+CH3COO]- | 613.37455 | 255.2 |
[M+Na-2H]- | 575.33537 | 225.6 |
[M]+ | 554.36015 | 233.9 |
[M]- | 554.36125 | 233.9 |
Literature stripe
Patent stripe
No patent data available for this compound.