KNApSAcK Metabolite C00030094
Metabolite
KNApSAcK Entry
| id | C00030094 |
|---|---|
| Name | 6alpha-Hydroxygeniposide / Methyl deacetylasperulosidate / Deacetylasperulosidic acid methyl ester |
| CAS RN | 52613-28-2 |
| Standard InChI | InChI=1S/C17H24O11/c1-25-15(24)7-5-26-16(10-6(3-18)2-8(20)11(7)10)28-17-14(23)13(22)12(21)9(4-19)27-17/h2,5,8-14,16-23H,3-4H2,1H3/t8-,9+,10+,11-,12+,13-,14+,16-,17-/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C17H24O11/c1-25-15(24)7-5-26-16(10-6(3-18)2-8(20)11(7)10)28-17-14(23)13(22)12(21)9(4-19)27-17/h2,5,8-14,16-23H,3-4H2,1H3 |
Cluster
| Phytochemical cluster | No. 36 |
|---|---|
| KCF-S cluster | No. 100 |
Link
ChEMBL
| By standard InChI | CHEMBL463096 |
|---|---|
| By standard InChI Main Layer | CHEMBL463096 CHEMBL516850 |
KEGG
| By LinkDB |
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CTD
| By CAS RN |
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