| SpectraBase Compound ID | 3eVuuTblmjl |
|---|---|
| InChI | InChI=1S/C32H30N6O8S4/c1-13(39)29-25(45)37-21-27(15-9-5-7-11-17(15)33-21,19(41)31(37,49-47-29)23(43)35(29)3)28-16-10-6-8-12-18(16)34-22(28)38-26(46)30(14(2)40)36(4)24(44)32(38,20(28)42)50-48-30/h5-13,19-22,33-34,39,41-42H,1-4H3/t13?,19-,20-,21+,22+,27?,28?,29-,30-,31-,32-/m0/s1 |
| InChIKey | YMYVOCNKQGGHNP-NYWZEVOTSA-N |
| Mol Weight | 754.9 g/mol |
| Molecular Formula | C32H30N6O8S4 |
| Exact Mass | 754.100797 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7aomm31mnG0 |
|---|---|
| Name | VERTICILLIN-F |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H30N6O8S4 |
| InChI | InChI=1S/C32H30N6O8S4/c1-13(39)29-25(45)37-21-27(15-9-5-7-11-17(15)33-21,19(41)31(37,49-47-29)23(43)35(29)3)28-16-10-6-8-12-18(16)34-22(28)38-26(46)30(14(2)40)36(4)24(44)32(38,20(28)42)50-48-30/h5-13,19-22,33-34,39,41-42H,1-4H3/t13?,19-,20-,21+,22+,27?,28?,29-,30-,31-,32-/m0/s1 |
| InChIKey | YMYVOCNKQGGHNP-NYWZEVOTSA-N |
| Literature Reference Author | B.K.JOSHI,J.B.GLOER,D.T.WICKLOW |
| Literature Reference Citation | J.NAT.PROD.,62,730(1999) |
| Literature Reference DOI | 10.1021/np980530x |
| Molecular Weight | 754.866 g/mol |
| Solvent | ACETONE-D6 |
| Source File Reference | UWCP7848 |