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(Q105147262)
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English
Indicanine D
group of stereoisomers with the chemical formula C₅₁H₇₈O₇
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Statements
instance of
group of stereoisomers
0 references
subclass of
6,8C-substituted isoflavone
1 reference
inferred from
6,8C-substituted isoflavone
mass
802.574754836
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₅₁H₇₈O₇
0 references
canonical SMILES
O=C1C(=COC2=C1C(O)=C(C(O)=C2CC(O)C(=C)C)CC=C(C)C)C=3C=CC(OC(CO)CCCCCCCCCCCCCCCCCCCCCCCC)=CC3
0 references
found in taxon
Erythrina fusca
1 reference
stated in
Cytotoxic isoflavones from Erythrina indica.
Identifiers
InChI
InChI=1S/C51H78O7/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-42(36-52)58-41-32-30-40(31-33-41)45-37-57-51-44(35-46(53)39(4)5)48(54)43(34-29-38(2)3)49(55)47(51)50(45)56/h29-33,37,42,46,52-55H,4,6-28,34-36H2,1-3,5H3
0 references
InChIKey
KXBPSKSPRYVSAE-UHFFFAOYSA-N
0 references
PubChem CID
10328008
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
KXBPSKSPRYVSAE-UHFFFAOYSA-N
UniChem compound ID
33727990
1 reference
stated in
UniChem
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