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1-(Acetyloxy)-6-(5,9a-dimethyl-2,7-dioxo-5,5a,6,7,9,9a-hexahydro-2H-pyrano[3,4-b]oxepin-5-yl)-5-(formyloxy)-3-(furan-3-yl)-7a-hydroxy-3a-methyl-7-methylideneoctahydro-1H-inden-4-yl 2-hydroxy-3-methylpentanoate

HCID 155478
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Basic information

CAS
70237-69-3
Standard SMILES
C=C1[C@@H]([C@@]2(C)C=CC(=O)O[C@@]3(C)COC(=O)C[C@H]23)[C@@H](OC=O)[C@H](OC(=O)[C@H](O)[C@@H](C)CC)[C@@]2(C)C(c3ccoc3)C[C@H](OC(C)=O)[C@]12O
InChIKey
ZZPUDABJUQWRTM-UVAHNWPKSA-N
Molecular formula
C35H44O13
Average molar mass
672.724 g/mol
Monoisotopic mass
672.27819147

Names & identifiers

Preferred name
1-(Acetyloxy)-6-(5,9a-dimethyl-2,7-dioxo-5,5a,6,7,9,9a-hexahydro-2H-pyrano[3,4-b]oxepin-5-yl)-5-(formyloxy)-3-(furan-3-yl)-7a-hydroxy-3a-methyl-7-methylideneoctahydro-1H-inden-4-yl 2-hydroxy-3-methylpentanoate
IUPAC
(1S,3aR,4R,5R,6R,7aS)-1-(Acetyloxy)-6-[(5R,5aR,9aR)-5,9a-dimethyl-2,7-dioxo-5,5a,6,7,9,9a-hexahydro-2H-pyrano[3,4-b]oxepin-5-yl]-5-(formyloxy)-3-(furan-3-yl)-7a-hydroxy-3a-methyl-7-methylideneoctahydro-1H-inden-4-yl (2R,3S)-2-hydroxy-3-methylpentanoate

Database identifiers

CAS
70237-69-3
PubChem CID
155478
DTXSID
DTXSID30990465

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