| SpectraBase Compound ID | 4K6HQpc93uT |
|---|---|
| InChI | InChI=1S/C29H42N6O5/c1-19(2)16-23(35-28(40)25(37)18-21-10-12-22(36)13-11-21)27(39)34-24(17-20-8-4-3-5-9-20)26(38)32-14-6-7-15-33-29(30)31/h3-5,8-13,19,23-25,36-37H,6-7,14-18H2,1-2H3,(H,32,38)(H,34,39)(H,35,40)(H4,30,31,33)/t23-,24+,25-/m1/s1 |
| InChIKey | QSELNASSFIOFMX-DSNGMDLFSA-N |
| Mol Weight | 554.7 g/mol |
| Molecular Formula | C29H42N6O5 |
| Exact Mass | 554.321668 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 40vsHJQIXCY |
|---|---|
| Name | PSEUDOAERUGINOSIN_KT_554 |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H42N6O5 |
| InChI | InChI=1S/C29H42N6O5/c1-19(2)16-23(35-28(40)25(37)18-21-10-12-22(36)13-11-21)27(39)34-24(17-20-8-4-3-5-9-20)26(38)32-14-6-7-15-33-29(30)31/h3-5,8-13,19,23-25,36-37H,6-7,14-18H2,1-2H3,(H,32,38)(H,34,39)(H,35,40)(H4,30,31,33)/t23-,24+,25-/m1/s1 |
| InChIKey | QSELNASSFIOFMX-DSNGMDLFSA-N |
| Literature Reference Author | M.LIFSHITS,S.CARMELI |
| Literature Reference Citation | J.NAT.PROD.,75,209(2012) |
| Literature Reference DOI | 10.1021/np200909x |
| Molecular Weight | 554.690 g/mol |
| Sample ID | 40034 |
| Solvent | DMSO-D6 |