| SpectraBase Compound ID | H362CtwWfOS |
|---|---|
| InChI | InChI=1S/C48H81N9O8/c1-12-28(7)37-45(62)50-32(11)41(58)54-38(29(8)13-2)46(63)51-34(23-19-20-24-49)42(59)55-40(31(10)15-4)48(65)57-39(30(9)14-3)47(64)53-36(26-33-21-17-16-18-22-33)43(60)52-35(25-27(5)6)44(61)56-37/h16-18,21-22,27-32,34-40H,12-15,19-20,23-26,49H2,1-11H3,(H,50,62)(H,51,63)(H,52,60)(H,53,64)(H,54,58)(H,55,59)(H,56,61)(H,57,65)/t28-,29-,30-,31-,32-,34-,35+,36-,37+,38+,39-,40-/m1/s1 |
| InChIKey | DOYCSKUONIMFLG-RQYQKZJXSA-N |
| Mol Weight | 912.2 g/mol |
| Molecular Formula | C48H81N9O8 |
| Exact Mass | 911.620811 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | C6BLPmNwVv8 |
|---|---|
| Name | CHAMPACYCLIN |
| Compound Number | 1A |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H81N9O8 |
| InChI | InChI=1S/C48H81N9O8/c1-12-28(7)37-45(62)50-32(11)41(58)54-38(29(8)13-2)46(63)51-34(23-19-20-24-49)42(59)55-40(31(10)15-4)48(65)57-39(30(9)14-3)47(64)53-36(26-33-21-17-16-18-22-33)43(60)52-35(25-27(5)6)44(61)56-37/h16-18,21-22,27-32,34-40H,12-15,19-20,23-26,49H2,1-11H3,(H,50,62)(H,51,63)(H,52,60)(H,53,64)(H,54,58)(H,55,59)(H,56,61)(H,57,65)/t28-,29-,30-,31-,32-,34-,35+,36-,37+,38+,39-,40-/m1/s1 |
| InChIKey | DOYCSKUONIMFLG-RQYQKZJXSA-N |
| Literature Reference Author | A.PESIC,H.I.BAUMANN,K.KLEINSCHMIDT,P.ENSLE,J.WIESE,R.D.SUSSM UTH,J.F.IMHOFF |
| Literature Reference Citation | MAR.DRUGS,11,4834(2013) |
| Literature Reference DOI | 10.3390/md11124834 |
| Molecular Weight | 912.227 g/mol |
| Source File Reference | UWBT6648 |