| SpectraBase Compound ID | KtN99JESd8b |
|---|---|
| InChI | InChI=1S/C46H72O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-34-37-40-43-46(48)44-41-38-35-32-31-33-36-39-42-45(47)4-2/h1-2,5-6,21-22,27-28,45-48H,7-20,23-26,29-39,42H2/b6-5-,22-21-,28-27-/t45-,46+/m1/s1 |
| InChIKey | WZGVLTCUKBJJMW-MBQJZNLDSA-N |
| Mol Weight | 657.1 g/mol |
| Molecular Formula | C46H72O2 |
| Exact Mass | 656.553232 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1Tqga0NGPXl |
|---|---|
| Name | PETROCORTYNE_D |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C46H72O2 |
| InChI | InChI=1S/C46H72O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-34-37-40-43-46(48)44-41-38-35-32-31-33-36-39-42-45(47)4-2/h1-2,5-6,21-22,27-28,45-48H,7-20,23-26,29-39,42H2/b6-5-,22-21-,28-27-/t45-,46+/m1/s1 |
| InChIKey | WZGVLTCUKBJJMW-MBQJZNLDSA-N |
| Literature Reference Author | J.SHIN,Y.SEO,K.W.CHO |
| Literature Reference Citation | J.NAT.PROD.,61,1268(1998) |
| Literature Reference DOI | 10.1021/np9802015 |
| Molecular Weight | 657.076 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ951 |