| SpectraBase Compound ID | 5bpOBlDOq9K |
|---|---|
| InChI | InChI=1S/C14H13N5O8/c15-9-5-10(17-2-16-9)19(3-18-5)11-6(20)7-4(26-11)1-14(27-7,13(24)25)8(21)12(22)23/h1-3,6-8,11,20-21H,(H,22,23)(H,24,25)(H2,15,16,17)/t6-,7-,8?,11-,14+/m0/s1 |
| InChIKey | IAPZXUKYTCQQFE-OYPAKDAPSA-N |
| Mol Weight | 379.29 g/mol |
| Molecular Formula | C14H13N5O8 |
| Exact Mass | 379.076412 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I3a0XFHhubg |
|---|---|
| Name | GRISEOLIC-ACID |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C14H13N5O8 |
| InChI | InChI=1S/C14H13N5O8/c15-9-5-10(17-2-16-9)19(3-18-5)11-6(20)7-4(26-11)1-14(27-7,13(24)25)8(21)12(22)23/h1-3,6-8,11,20-21H,(H,22,23)(H,24,25)(H2,15,16,17)/t6-,7-,8?,11-,14+/m0/s1 |
| InChIKey | IAPZXUKYTCQQFE-OYPAKDAPSA-N |
| Literature Reference Author | R.COOPER,R.MIERZWA,M.PATEL,B.PRAMANIK,M.S.PUAR,J.TROYANOVICH ,V.GULLO |
| Literature Reference Citation | J.NAT.PROD.,51,1207(1988) |
| Literature Reference DOI | 10.1021/np50060a025 |
| Molecular Weight | 379.286 g/mol |
| Solvent | D2O |
| Source File Reference | UWCS13906 |