Details of MARSDENOSIDE F
| IUPAC | [(1S,3R,6R,7S,8S,9S,10S,11S,14S,16S)-6-acetyl-8-acetyloxy-14-[(2R,4R,5R,6R)-5-[(2S,3R,4R,5R,6R)-3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-7,11-dimethyl-2-oxapentacyclo[8.8.0.01,3.03,7.011,16]octadecan-9-yl] acetate |
| Canonical Smiles | CC1C(C(C(C(O1)OC2C(OC(CC2OC)OC3CCC4(C(C3)CCC56C4C(C(C7(C5(O6)CCC7C(=O)C)C)OC(=O)C)OC(=O)C)C)C)O)OC)O |
| Inchi | BLRABBHSPXPECV-IYNXUUSNSA-N |
| PubChem ID | 11343196 |
| Smiles | COC1CC(OC2CCC3(C)C(CCC45OC46CCC(C(C)=O)C6(C)C(OC(C)=O)C(OC(C)=O)C35)C2)OC(C)C1OC1OC(C)C(O)C(OC)C1O |
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| Class | Pregnane steroids |
| Super Class | Steroids |
| Pathways | Terpenoids |
