| SpectraBase Compound ID | 92c42t15Q0c |
|---|---|
| InChI | InChI=1S/C49H68N8O12/c1-10-15-37(59)50-28(7)42(61)53-39(26(3)4)45(64)55-41-29(8)69-49(68)40(27(5)6)54-44(63)35(24-31-18-20-32(58)21-19-31)56(9)48(67)36(25-30-16-13-12-14-17-30)57-38(60)23-22-34(47(57)66)52-43(62)33(11-2)51-46(41)65/h11-14,16-21,26-29,34-36,38-41,58,60H,10,15,22-25H2,1-9H3,(H,50,59)(H,51,65)(H,52,62)(H,53,61)(H,54,63)(H,55,64)/b33-11-/t28-,29+,34-,35-,36-,38+,39-,40-,41-/m0/s1 |
| InChIKey | KROYJVUBAIMQLZ-MOVCJJAASA-N |
| Mol Weight | 961.1 g/mol |
| Molecular Formula | C49H68N8O12 |
| Exact Mass | 960.49567 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4O9Z072grl |
|---|---|
| Name | LYNGBYASTATIN-9 |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C49H68N8O12 |
| InChI | InChI=1S/C49H68N8O12/c1-10-15-37(59)50-28(7)42(61)53-39(26(3)4)45(64)55-41-29(8)69-49(68)40(27(5)6)54-44(63)35(24-31-18-20-32(58)21-19-31)56(9)48(67)36(25-30-16-13-12-14-17-30)57-38(60)23-22-34(47(57)66)52-43(62)33(11-2)51-46(41)65/h11-14,16-21,26-29,34-36,38-41,58,60H,10,15,22-25H2,1-9H3,(H,50,59)(H,51,65)(H,52,62)(H,53,61)(H,54,63)(H,55,64)/b33-11-/t28-,29+,34-,35-,36-,38+,39-,40-,41-/m0/s1 |
| InChIKey | KROYJVUBAIMQLZ-MOVCJJAASA-N |
| Literature Reference Author | J.C.KWAN,K.TAORI,V.J.PAUL,H.LUESCH |
| Literature Reference Citation | MAR.DRUGS,7,528(2009) |
| Literature Reference DOI | 10.3390/md7040528 |
| Molecular Weight | 961.125 g/mol |
| Source File Reference | UWIR6320 |