Structure Information
Structure

Compound Identification

SMILES

C[C@H](CCC(=O)O[C@@H]1C[C@@H]2C[C@@H](CC[C@]2(C)[C@H]2C[C@H](OC(=O)CC[C@@H](C)[C@H]3CCC4C5C(O)CC6C[C@@H](CC[C@]6(C)C5CC[C@]34C)OC3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(O)=O)[C@]3(C)[C@H](CC[C@H]3[C@H]12)[C@H](C)CCC(O)=O)OC1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(O)=O)[C@H]1CCC2C3CCC4C[C@@H](CC[C@]4(C)C3CC[C@]12C)OC1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(O)=O

InChIKey

InChIKey=ZXLCJDSVZJHQJR-IZOZITTPSA-N

Formula

C90H140O28

Mass

1670.082

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JSON SDF CSV

Entity with smiles C[C@H](CCC(=O)O[C@@H]1C[C@@H]2C[C@@H](CC[C@]2(C)[C@H]2C[C@H](OC(=O)CC[C@@H](C)[C@H]3CCC4C5C(O)CC6C[C@@H](CC[C@]6(C)C5CC[C@]34C)OC3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(O)=O)[C@]3(C)[C@H](CC[C@H]3[C@H]12)[C@H](C)CCC(O)=O)OC1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(O)=O)[C@H]1CCC2C3CCC4C[C@@H](CC[C@]4(C)C3CC[C@]12C)OC1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(O)=O has not been classified yet.

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