| SpectraBase Compound ID | 2AR6MiU3qkH |
|---|---|
| InChI | InChI=1S/C37H59NO14/c1-21(2)28-14-12-10-8-6-4-5-7-9-11-13-24(50-36-34(45)32(38)33(44)22(3)49-36)18-29-31(35(46)47)27(42)20-37(48,52-29)19-23(39)17-26(41)25(40)15-16-30(43)51-28/h4-9,11,13,21-29,31-34,36,39-42,44-45,48H,10,12,14-20,38H2,1-3H3,(H,46,47)/b5-4+,8-6+,9-7+,13-11+/t22-,23?,24?,25?,26?,27?,28?,29?,31?,32+,33-,34+,36+,37?/m1/s1 |
| InChIKey | HCAJMOSNTHQEGE-CJUSSKBISA-N |
| Mol Weight | 741.9 g/mol |
| Molecular Formula | C37H59NO14 |
| Exact Mass | 741.393556 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8X72i6vJ1F9 |
|---|---|
| Name | YS-822-A |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H59NO14 |
| InChI | InChI=1S/C37H59NO14/c1-21(2)28-14-12-10-8-6-4-5-7-9-11-13-24(50-36-34(45)32(38)33(44)22(3)49-36)18-29-31(35(46)47)27(42)20-37(48,52-29)19-23(39)17-26(41)25(40)15-16-30(43)51-28/h4-9,11,13,21-29,31-34,36,39-42,44-45,48H,10,12,14-20,38H2,1-3H3,(H,46,47)/b5-4+,8-6+,9-7+,13-11+/t22-,23?,24?,25?,26?,27?,28?,29?,31?,32+,33-,34+,36+,37?/m1/s1 |
| InChIKey | HCAJMOSNTHQEGE-CJUSSKBISA-N |
| Literature Reference Author | H.HIROTA,A.ITOH,J.IDO,Y.IWAMOTO,E.GOSHIMA,T.MIKI,K.HASUDA,Y. OHASHI |
| Literature Reference Citation | J.ANTIBIOTICS,44,181(1991) |
| Literature Reference DOI | 10.7164/antibiotics.44.181 |
| Molecular Weight | 741.874 g/mol |
| Sample ID | 40533 |
| Solvent | DMSO-D6 |