Kadcoccinic acid I

Catalog No. :
ACGGKH161
CAS No. :
1802768-44-0
Molecular Formula :
C31H46O5
Molecular Weight :
498.70

IUPAC Name:(6R,Z)-6-((2R,4bR,5R,7S,8S,9aR)-8-(2-carboxyethyl)-9a-methoxy-5,8-dimethyl-1-methylene-7-(prop-1-en-2-yl)-2,3,4,4a,4b,5,6,7,8,9a-decahydro-1H-fluoren-2-yl)-2-methylhept-2-enoic acid

Kadcoccinic acid I structure diagram
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Product Information

Product NameKadcoccinic acid I
IUPAC Name(6R,Z)-6-((2R,4bR,5R,7S,8S,9aR)-8-(2-carboxyethyl)-9a-methoxy-5,8-dimethyl-1-methylene-7-(prop-1-en-2-yl)-2,3,4,4a,4b,5,6,7,8,9a-decahydro-1H-fluoren-2-yl)-2-methylhept-2-enoic acid
Molecular FormulaC31H46O5
Molecular Weight498.70
SMILESO=C(O)CC[C@]([C@H](C(C)=C)C[C@@H](C)[C@]1([H])C2CC[C@@H]3[C@H](C)CC/C=C(C(O)=O)/C)(C)C1=C[C@@]2(OC)C3=C
InChI KeyWTZDVJDJXXEZBD-CKMNHEDWSA-N
Synonym1H-Fluorene-1-propanoic acid, 7-[(1R,4Z)-5-carboxy-1-methyl-4-hexen-1-yl]-2,3,4,4a,4b,5,6,7,8,8a-decahydro-8a-methoxy-1,4b-dimethyl-8-methylene-2-(1-methylethenyl)-, (1S,2S,4aR,4bS,7R,8aR)-
CAS No.1802768-44-0

Safety Data

Pictogram
Harmful or irritant
Signal Word
Achtung
Hazard Statement(s)
H302-H315-H319-H335
Precautionary Statement(s)
P261-P280-P301+P312-P302+P352-P305+P351+P338

Synthetic Route by SureRoute

1. ACGGKH161 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACGGKH161 route product structure diagram
    ACGGKH1611802768-44-0
Inquiry

2. ACGGKH161 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACGGKH161 route product structure diagram
    ACGGKH1611802768-44-0
Inquiry

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