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(Q74411127)
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11-hydroxyferruginol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
catechol
0 references
mass
302.2245802
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₂₀H₃₀O₂
0 references
canonical SMILES
CC(C)c1cc2c(c(O)c1O)C1(C)CCCC(C)(C)C1CC2
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CC(C)C1=C(C(=C2C(=C1)CC[C@@H]3[C@@]2(CCCC3(C)C)C)O)O
0 references
Identifiers
InChI
InChI=1S/C20H30O2/c1-12(2)14-11-13-7-8-15-19(3,4)9-6-10-20(15,5)16(13)18(22)17(14)21/h11-12,15,21-22H,6-10H2,1-5H3/t15-,20-/m0/s1
0 references
InChIKey
MUVSVZOWXAYLSD-YWZLYKJASA-N
2 references
stated in
ChEBI release 2019-11-01
stated in
ChEBI release 2020-09-01
PubChem CID
46832173
1 reference
matched by identifier from
InChIKey
InChIKey
MUVSVZOWXAYLSD-YWZLYKJASA-N
Reaxys registry number
5756130
1 reference
stated in
ChEBI release 2019-11-01
ChEBI ID
138942
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C20H30O2/c1-12(2)14-11-13-7-8-15-19(3,4)9-6-10-20(15,5)16(13)18(22)17(14)21/h11-12,15,21-22H,6-10H2,1-5H3/t15-,20-/m0/s1
UniChem compound ID
32713904
1 reference
stated in
UniChem
KNApSAcK ID
C00052541
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
MUVSVZOWXAYLSD-YWZLYKJASA-N
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