Information from the InChI
There are no matching entries in the database for this IUPAC International Chemical Identifier. The following information was obtained from the identifier.
- Formula: C9H17NO5·C4H6N4O3·Ca+2
- Molecular weight: 417.427
- IUPAC Standard InChI:
- InChI=1S/C9H17NO5.C4H6N4O3.Ca/c1-9(2,5-11)7(14)8(15)10-4-3-6(12)13;5-3(10)6-1-2(9)8-4(11)7-1;/h7,11,14H,3-5H2,1-2H3,(H,10,15)(H,12,13);1H,(H3,5,6,10)(H2,7,8,9,11);/q;; 2/t7-;;/m0../s1
- IUPAC Standard InChIKey: KYQGGQYGUFIYIM-UHFFFAOYSA-N
- Connectivity:
- 2-d Mol File from the identifier
- Canonical atom numbers:
Note: stereochemistry is currently not indicated in the items above. - Permanent link for this search. Use this link for bookmarking this species for future reference.
Contents of the identifier
Identifier version: 1
Main section
- Formula: C9H17NO5.C4H6N4O3.Ca
- Connectivity: 1-9(2,5-11)7(14)8(15)10-4-3-6(12)13;5-3(10)6-1-2(9)8-4(11)7-1;
- Hydrogen: 7,11,14H,3-5H2,1-2H3,(H,10,15)(H,12,13);1H,(H3,5,6,10)(H2,7,8,9,11);
- Charge: ;; 2
- sp3 Stereo: 7-;;
- Stereo type: 1