| SpectraBase Compound ID | DcR2ao9VGGZ |
|---|---|
| InChI | InChI=1S/C53H74N6O10/c1-9-19-38-35(7)52(66)68-42(31-37-22-14-11-15-23-37)48(62)59-29-18-26-41(59)53(67)69-45(33(4)5)51(65)56(8)44(32(2)3)50(64)58-28-17-25-40(58)47(61)55-43(34(6)30-36-20-12-10-13-21-36)49(63)57-27-16-24-39(57)46(60)54-38/h10-15,20-23,32-35,38-45H,9,16-19,24-31H2,1-8H3,(H,54,60)(H,55,61)/t34-,35-,38-,39+,40+,41+,42+,43+,44-,45+/m1/s1 |
| InChIKey | HEQFVTIDWBACAH-MGRSABLUSA-N |
| Mol Weight | 955.2 g/mol |
| Molecular Formula | C53H74N6O10 |
| Exact Mass | 954.546643 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K1wWVtSgljv |
|---|---|
| Name | KULOKEKAHILIDE-1 |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C53H74N6O10 |
| InChI | InChI=1S/C53H74N6O10/c1-9-19-38-35(7)52(66)68-42(31-37-22-14-11-15-23-37)48(62)59-29-18-26-41(59)53(67)69-45(33(4)5)51(65)56(8)44(32(2)3)50(64)58-28-17-25-40(58)47(61)55-43(34(6)30-36-20-12-10-13-21-36)49(63)57-27-16-24-39(57)46(60)54-38/h10-15,20-23,32-35,38-45H,9,16-19,24-31H2,1-8H3,(H,54,60)(H,55,61)/t34-,35-,38-,39+,40+,41+,42+,43+,44-,45+/m1/s1 |
| InChIKey | HEQFVTIDWBACAH-MGRSABLUSA-N |
| Literature Reference Author | J.KIMURA,Y.TAKADA,T.INAYOSHI,Y.NAKAO,G.GOETZ,W.Y.YOSHIDA,P.J .SCHEUER |
| Literature Reference Citation | J.ORG.CHEM.,67,1760(2002) |
| Literature Reference DOI | 10.1021/jo010176z |
| Molecular Weight | 955.205 g/mol |
| Solvent | CD3CN |
| Source File Reference | UWLU24965 |