PETROTRIYNDIOL
Compound with spectra: 1 NMR
| SpectraBase Compound ID | DwaAf197BKm |
|---|---|
| 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/h1-2,5-6,21-22,27-28,39-40,42-43,45-48H,7-20,23-26,29-38H2/b6-5+,22-21+,28-27+,42-39+,43-40+/t45-,46-/m1/s1 |
| InChIKey | RWNBIJPLTYHBMT-VUESWVKYSA-N |
| Mol Weight | 657.1 g/mol |
| Molecular Formula | C46H72O2 |
| Exact Mass | 656.553232 g/mol |
| Enantiomer InChIKey | RWNBIJPLTYHBMT-WQJORTPDSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CD3OD |
(3S,14S)-PETROCORTYNEB
(3R,4E,14R,21Z,27Z)-hexatetraconta-4,21,27-trien-1,12,15,45-tetrayne-3,14-diol
STRONGYLODIOL_J
(-)-PETROSYNOIC_ACID_B
CORTICATIC-ACID-A
DIDEOXYPETROSYNOL-E
PELLYNOL-L
31-(R)-HYDROXY-TRITRIACONTA-4-(Z),15-(Z),29-(E)-TRIENE-2,32-DIYNOIC-ACID-METHYLESTER
Pellynic acid methyl ester
(-)-PETROSYNOIC_ACID_C
| Title | Journal or Book | Year |
|---|---|---|
| Additional Cytotoxic Polyacetylenes from the Marine Sponge Petrosia Species | Journal of Natural Products | 2000 |
This compound is available in the following databases:
KnowItAll NMR Spectral Library
Author: Wiley
The KnowItAll NMR Spectral Library offers a comprehensive collection of NMR reference spectra, including NMR, CNMR, and XNMR, and covers a wide range of compounds including organics, polymers, monomers, metabolites, and more. Learn more.