(3S,5S)-7-[(1s,2r,3r,4s,6r,8s,8Ar)-3,4,6-trihydroxy-2-methyl-8-(2-methylbutanoyloxy)-1,2,3,4,6,7,8,8a-octahydronaphthalen-1-yl]-3,5-dihydroxyheptanoic acid

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CAS
135690-31-2
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Purity
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Catalog Number

ACM135690312

Product Name

(3S,5S)-7-[(1s,2r,3r,4s,6r,8s,8Ar)-3,4,6-trihydroxy-2-methyl-8-(2-methylbutanoyloxy)-1,2,3,4,6,7,8,8a-octahydronaphthalen-1-yl]-3,5-dihydroxyheptanoic acid

CAS

135690-31-2

Category

Heterocyclic Organic Compound

Synonyms

135690-31-2, (3S,5S)-3,5-dihydroxy-7-{(1S,2R,3R,4S,6R,8S,8aR)-3,4,6-trihydroxy-2-methyl-8-[(2-methylbutanoyl)oxy]-1,2,3,4,6,7,8,8a-octahydronaphthalen-1-yl}heptanoic acid

IUPAC Name

3,5-dihydroxy-7-[3,4,6-trihydroxy-2-methyl-8-(2-methylbutanoyloxy)-1,2,3,4,6,7,8,8a-octahydronaphthalen-1-yl]heptanoic acid

Molecular Weight

458.542 g/mol

Molecular Formula

C₂₃H₃₈O₉

Canonical SMILES

CCC(C)C(=O)OC1CC(C=C2C1C(C(C(C2O)O)C)CCC(CC(CC(=O)O)O)O)O

InChI Key

BVWLCXJEPYNBRS-UHFFFAOYSA-N

H-Bond Acceptor

H-Bond Donor