Details of TAXUSPINE-A
| IUPAC | [(2S,4R,5R,5aS,6S,8S,9aR,10aS)-2,5,6-triacetyloxy-10a-(2-hydroxypropan-2-yl)-3,5a-dimethyl-9-methylidene-8-[(E)-3-phenylprop-2-enoyl]oxy-2,4,5,6,7,8,9a,10-octahydro-1H-benzo[g]azulen-4-yl] benzoate |
| Canonical Smiles | CC1=C2C(C(C3(C(CC(C(=C)C3CC2(CC1OC(=O)C)C(C)(C)O)OC(=O)C=CC4=CC=CC=C4)OC(=O)C)C)OC(=O)C)OC(=O)C5=CC=CC=C5 |
| Inchi | MWIQLLBFLJOMOS-MHXMLUCXSA-N |
| PubChem ID | 10417482 |
| Smiles | C=C1C(OC(=O)C=Cc2ccccc2)CC(OC(C)=O)C2(C)C1CC1(C(C)(C)O)CC(OC(C)=O)C(C)=C1C(OC(=O)c1ccccc1)C2OC(C)=O |
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