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(Q104400480)
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English
(5'-acetyloxy-1,1,4a,7,7',8a-hexamethylspiro[2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-8,2'-3H-1-benzofuran]-2-yl) acetate
group of stereoisomers with the chemical formula C₃₁H₄₄O₅
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Statements
instance of
group of stereoisomers
0 references
subclass of
isocopalane diterpenoid
1 reference
inferred from
isocopalane diterpenoid
grisan-type benzofuranoid
1 reference
inferred from
grisan-type benzofuranoid
mass
496.31887450799985
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₃₁H₄₄O₅
0 references
canonical SMILES
O=C(OC=1C=C(C=2OC3(CC2C1)C(C)CCC4C5(C)CCC(OC(=O)C)C(C)(C)C5CCC43C)C)C
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Identifiers
InChI
InChI=1S/C31H44O5/c1-18-15-23(34-20(3)32)16-22-17-31(36-27(18)22)19(2)9-10-25-29(7)13-12-26(35-21(4)33)28(5,6)24(29)11-14-30(25,31)8/h15-16,19,24-26H,9-14,17H2,1-8H3
0 references
InChIKey
ISRQFIPAMDLIMC-UHFFFAOYSA-N
0 references
PubChem CID
162950353
1 reference
based on heuristic
inferred from InChIKey
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