SpectraBase Compound ID | 4PoIrEwaGKA |
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InChI | InChI=1S/C30H51NO3/c1-23(2)13-11-16-25(4)18-12-17-24(3)14-9-10-15-26(5)19-20-27-30(6,29(33)34-8)28(32)21-22-31(27)7/h13-15,18,27-28,32H,9-12,16-17,19-22H2,1-8H3/b24-14+,25-18+,26-15+/t27-,28-,30-/m0/s1 |
InChIKey | YZRJFXNRSVSODV-ALYQLORNSA-N |
Mol Weight | 473.7 g/mol |
Molecular Formula | C30H51NO3 |
Exact Mass | 473.386895 g/mol |
SpectraBase Spectrum ID | Jx96WynCyUC |
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Name | 3-Carbomethoxy-1,3-dimethyl-2-[3,8,12,16-tetramethyl-3(E),7(E),11(E),15-heptadecatetraenyl]-4-piperidinol |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C30H51NO3 |
InChI | InChI=1S/C30H51NO3/c1-23(2)13-11-16-25(4)18-12-17-24(3)14-9-10-15-26(5)19-20-27-30(6,29(33)34-8)28(32)21-22-31(27)7/h13-15,18,27-28,32H,9-12,16-17,19-22H2,1-8H3/b24-14+,25-18+,26-15+/t27-,28-,30-/m0/s1 |
InChIKey | YZRJFXNRSVSODV-ALYQLORNSA-N |
Molecular Weight | 473.742 g/mol |
SMILES | O[C@@]1([C@]([C@@](N(C)CC1)(CC\C(=C\CC\C=C\(CC\C=C\(CCC=C(C)C)C)C)C)[H])(C(=O)OC)C)[H] |
SPLASH | splash10-000i-4920000000-dab2c52dc9f480a33dce |
Source of Spectrum | J-57-7233-33 |
Synonyms | (2S,3S,4S)-3-Carbomethoxy-1,3-dimethyl-2-[3,8,12,16-tetramethyl-3(E),7(E),11(E),15-heptadecatetraenyl]-4-piperidinol Methyl 4-hydroxy-1,3-dimethyl-2-[(3E,7E,11E)-3,8,12,16-tetramethyl-3,7,11,15-heptadecatetraenyl]-3-piperidinecarboxylate (2S,3S,4S)-4-hydroxy-1,3-dimethyl-2-[(3E,7E,11E)-3,8,12,16-tetramethylheptadeca-3,7,11,15-tetraenyl]-3-piperidinecarboxylic acid methyl ester Methyl (2S,3S,4S)-4-hydroxy-1,3-dimethyl-2-[(3E,7E,11E)-3,8,12,16-tetramethylheptadeca-3,7,11,15-tetraenyl]piperidine-3-carboxylate Methyl (2S,3S,4S)-1,3-dimethyl-4-oxidanyl-2-[(3E,7E,11E)-3,8,12,16-tetramethylheptadeca-3,7,11,15-tetraenyl]piperidine-3-carboxylate |
Wiley ID | 1393673 |