SpectraBase Compound ID | BDnmYXS1FrN |
---|---|
InChI | InChI=1S/C22H25NO7/c1-27-17-10-14-13(6-8-16(17)25)20-12(5-7-15(14)23-19(26)11-24)9-18(28-2)21(29-3)22(20)30-4/h6,8-10,15,24H,5,7,11H2,1-4H3,(H,23,26)/t15-/m0/s1 |
InChIKey | GGQSFWAWYCCUHN-HNNXBMFYSA-N |
Mol Weight | 415.44 g/mol |
Molecular Formula | C22H25NO7 |
Exact Mass | 415.163102 g/mol |
SpectraBase Spectrum ID | JJPTaOr3skx |
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Name | isocolchifoline |
CAS Registry Number | 78517-63-2 |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C22H25NO7 |
InChI | InChI=1S/C22H25NO7/c1-27-17-10-14-13(6-8-16(17)25)20-12(5-7-15(14)23-19(26)11-24)9-18(28-2)21(29-3)22(20)30-4/h6,8-10,15,24H,5,7,11H2,1-4H3,(H,23,26)/t15-/m0/s1 |
InChIKey | GGQSFWAWYCCUHN-HNNXBMFYSA-N |
Molecular Weight | 415.442 g/mol |
SMILES | N([C@@]1(C2=C(c3c(c(OC)c(cc3CC1)OC)OC)C=CC(=O)C(=C2)OC)[H])C(CO)=O |
SPLASH | splash10-03di-0009000000-95afd1f357fe6bb24a4a |
Source of Spectrum | I-59-284-6 |
Wiley ID | 1375974 |