MSI_000043860

Unreliable

排名分数: 1.23
参考来源: Homo sapiens (UBERON:0001043: esophagus)

M/z: 615.3675
Mass Window: 615.3675 ~ 615.3675 (none)

参考注释

3-trans-Caffeoyltormentic acid_[M+H-2H2O]+ (BioDeep_00000036212)
10-{[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-1,11-dihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylic acid

Formula: C39H54O8 (650.3818484000001)
SMILES:

OC1=C(O)C=CC(/C=C/C(O[C@@H]2C(C)(C)[C@@](CC[C@]3(C)[C@]4([H])CC=C5[C@@]3(C)CC[C@]6(C(O)=O)[C@@]5([H])[C@](C)(O)[C@H](C)CC6)([H])[C@]4(C)C[C@H]2O)=O)=C1

3-trans-Caffeoyltormentic acid is found in fruits. 3-trans-Caffeoyltormentic acid is a constituent of Eriobotrya japonica (loquat). Constituent of Eriobotrya japonica (loquat). 3-trans-Caffeoyltormentic acid is found in loquat and fruits.