| SpectraBase Compound ID | 3k3pO4us2xz |
|---|---|
| InChI | InChI=1S/C33H46N6O7/c1-7-17(6)27-31(43)37-26(16(4)5)30(42)36-23(33(45)46)13-19-14-34-22-12-18(8-9-20(19)22)25(15(2)3)28(32(44)38-27)39-29(41)21-10-11-24(40)35-21/h8-9,12,14-17,21,23,25-28,34H,7,10-11,13H2,1-6H3,(H,35,40)(H,36,42)(H,37,43)(H,38,44)(H,39,41)(H,45,46)/t17?,21?,23-,25-,26-,27-,28-/m0/s1 |
| InChIKey | UZOLEYGIZGZREX-IPGMYJHRSA-N |
| Mol Weight | 638.8 g/mol |
| Molecular Formula | C33H46N6O7 |
| Exact Mass | 638.342798 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | L8MZ71FFl0g |
|---|---|
| Name | STEPHANOTIC-ACID |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H46N6O7 |
| InChI | InChI=1S/C33H46N6O7/c1-7-17(6)27-31(43)37-26(16(4)5)30(42)36-23(33(45)46)13-19-14-34-22-12-18(8-9-20(19)22)25(15(2)3)28(32(44)38-27)39-29(41)21-10-11-24(40)35-21/h8-9,12,14-17,21,23,25-28,34H,7,10-11,13H2,1-6H3,(H,35,40)(H,36,42)(H,37,43)(H,38,44)(H,39,41)(H,45,46)/t17?,21?,23-,25-,26-,27-,28-/m0/s1 |
| InChIKey | UZOLEYGIZGZREX-IPGMYJHRSA-N |
| Literature Reference Author | K.YOSHIKAWA,S.TAO,S.ARIHARA |
| Literature Reference Citation | J.NAT.PROD.,63,540(2000) |
| Literature Reference DOI | 10.1021/np990532x |
| Molecular Weight | 638.764 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWCP8808 |