Chemical Structure Search
Search by chemical structure
Results 1 — 30 of approximately 49 results
PHUB000611 Score: 1.0 | Feruloyl tartaric acid precursor | C14H14O9 Mono mass: 326.063782031 | |
PHUB000579 Score: 0.938 | Caffeoyl tartaric acid precursor | C13H12O9 Mono mass: 312.048131966 | |
PHUB000580 Score: 0.938 | Caftaric acid precursor | C13H12O9 Mono mass: 312.048131966 | |
PHUB000584 Score: 0.923 | Chicoric acid precursor | C22H18O12 Mono mass: 474.07982602 | |
PHUB000596 Score: 0.875 | Coumaroyl tartaric acid (p-) precursor | C13H12O8 Mono mass: 296.053217346 | |
PHUB000595 Score: 0.859 | Coumaroyl malic acid (p-) precursor | C13H12O7 Mono mass: 280.058302726 | |
PHUB000541 Score: 0.828 | 4-Feruloylquinic acid precursor | C17H20O9 Mono mass: 368.110732224 | |
PHUB000529 Score: 0.824 | 3,5-Diferuloylquinic acid precursor | C27H28O12 Mono mass: 544.158076342 | |
PHUB000531 Score: 0.824 | 3-Feruloylquinic acid 87099-72-7 precursor | C17H20O9 Mono mass: 368.110732224 | |
PHUB000550 Score: 0.824 | 5-Feruloylquinic acid precursor | C17H20O9 Mono mass: 368.110732224 | |
PHUB000546 Score: 0.818 | 4-Sinapoylquinic acid precursor | C18H22O10 Mono mass: 398.121296908 | |
PHUB000535 Score: 0.815 | 3-Sinapoylquinic acid precursor | C18H22O10 Mono mass: 398.121296908 | |
PHUB000562 Score: 0.815 | 5-Sinapoylquinic acid precursor | C18H22O10 Mono mass: 398.121296908 | |
PHUB000526 Score: 0.813 | 3,4-Diferuloylquinic acid precursor | C27H28O12 Mono mass: 544.158076342 | |
PHUB002635 Score: 0.808 | 1,4-O-Dicaffeoylquinic acid 1182-34-9 precursor | C25H24O12 Mono mass: 516.126776213 | |
PHUB000512 Score: 0.797 | 1,3-Dicaffeoylquinic acid 30964-13-7 precursor | C25H24O12 Mono mass: 516.126776213 | |
PHUB000513 Score: 0.797 | 1,5-Dicaffeoylquinic acid 30964-13-7 precursor | C25H24O12 Mono mass: 516.126776213 | |
PHUB000603 Score: 0.797 | Dicaffeoylquinic acid precursor | C25H24O12 Mono mass: 516.126776213 | |
PHUB001922 Score: 0.797 | 1,3-O-Dicaffeoylquinic acid 30964-13-7 precursor | C25H24O12 Mono mass: 516.126776213 | |
PHUB000514 Score: 0.795 | 1-O-Caffeoylquinic acid 928005-87-2 precursor | C16H18O9 Mono mass: 354.09508216 | |
PHUB002424 Score: 0.781 | Feruloylquinic acid precursor | C17H20O9 Mono mass: 368.110732224 | |
PHUB002736 Score: 0.775 | 3,3'-Dimethoxyrosmarinic acid | C20H20O8 Mono mass: 388.115817604 | |
PHUB002738 Score: 0.775 | 3-Methoxyrosmarinic acid | C19H18O8 Mono mass: 374.10016754 | |
PHUB000537 Score: 0.772 | 4-O-Caffeoylquinic acid 905-99-7 precursor | C16H18O9 Mono mass: 354.09508216 | |
PHUB000528 Score: 0.77 | 3,5-Dicaffeoylquinic acid precursor | C25H24O12 Mono mass: 516.126776213 | |
PHUB000530 Score: 0.77 | 3-O-Caffeoylquinic acid 327-97-9 precursor | C16H18O9 Mono mass: 354.09508216 | |
PHUB000585 Score: 0.77 | 5-O-Caffeoylquinic acid 906-33-2 precursor | C16H18O9 Mono mass: 354.09508216 | |
PHUB000625 Score: 0.77 | Neochlorogenic acid precursor | C16H18O9 Mono mass: 354.09508216 | |
PHUB002735 Score: 0.77 | 3,4'-Dimethoxyrosmarinic acid | C20H20O8 Mono mass: 388.115817604 | |
PHUB002737 Score: 0.77 | 4,4'-Dimethoxyrosmarinic acid | C20H20O8 Mono mass: 388.115817604 | |
PHUB002741 Score: 0.77 | 4'-Methoxyrosmarinic acid | C19H18O8 Mono mass: 374.10016754 | |
PHUB002448 Score: 0.768 | 3',4-Dimethoxyrosmarinic acid | C20H20O8 Mono mass: 388.115817604 | |
PHUB002739 Score: 0.768 | 4-Methoxyrosmarinic acid | C19H18O8 Mono mass: 374.10016754 | |
PHUB002740 Score: 0.768 | 3'-Methoxyrosmarinic acid | C19H18O8 Mono mass: 374.10016754 |