CID 496630

Deoxydihydro-artemisinin

Structural Information

Molecular Formula
C15H24O4
SMILES
C[C@@H]1CC[C@H]2[C@H](C(O[C@H]3[C@@]24[C@H]1CCC(O3)(O4)C)O)C
InChI
InChI=1S/C15H24O4/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-15/h8-13,16H,4-7H2,1-3H3/t8-,9-,10+,11+,12?,13-,14?,15-/m1/s1
InChIKey
JQGOBHOUYKYFPD-YONALABKSA-N
Compound name
(4S,5R,8S,9R,12R,13R)-1,5,9-trimethyl-11,14,15-trioxatetracyclo[10.2.1.04,13.08,13]pentadecan-10-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

268.16745 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.17473 161.1
[M+Na]+ 291.15667 170.5
[M+NH4]+ 286.20127 173.3
[M+K]+ 307.13061 163.9
[M-H]- 267.16017 165.9
[M+Na-2H]- 289.14212 160.6
[M]+ 268.16690 164.1
[M]- 268.16800 164.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe