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(Q74411620)
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English
11,20-dihydroxysugiol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
primary alcohol
0 references
catechol
0 references
5,6-dihydroxy-4a-(hydroxymethyl)-1,1-dimethyl-7-propan-2-yl-3,4,10,10a-tetrahydro-2H-phenanthren-9-one
1 reference
based on heuristic
inferred from SMILES
mass
332.198759376
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₂₈O₄
0 references
canonical SMILES
O=C1C=2C=C(C(O)=C(O)C2C3(CO)CCCC(C)(C)C3C1)C(C)C
0 references
isomeric SMILES
CC(C)C1=C(C(=C2C(=C1)C(=O)C[C@@H]3[C@@]2(CCCC3(C)C)CO)O)O
0 references
found in taxon
Plectranthus hadiensis
1 reference
stated in
Abietanes and a Novel 20-Norabietanoid fromPlectranthus cyaneus (Lamiaceae)
Coleus hadiensis
1 reference
stated in
Abietanes and a Novel 20-Norabietanoid fromPlectranthus cyaneus (Lamiaceae)
Identifiers
InChI
InChI=1S/C20H28O4/c1-11(2)12-8-13-14(22)9-15-19(3,4)6-5-7-20(15,10-21)16(13)18(24)17(12)23/h8,11,15,21,23-24H,5-7,9-10H2,1-4H3/t15-,20+/m0/s1
0 references
InChIKey
PUXJVXOVZKVJTD-MGPUTAFESA-N
2 references
stated in
ChEBI release 2019-11-01
stated in
ChEBI release 2020-09-01
PubChem CID
12991809
1 reference
matched by identifier from
InChIKey
InChIKey
PUXJVXOVZKVJTD-MGPUTAFESA-N
Reaxys registry number
9805938
1 reference
stated in
ChEBI release 2019-11-01
ChEBI ID
138963
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C20H28O4/c1-11(2)12-8-13-14(22)9-15-19(3,4)6-5-7-20(15,10-21)16(13)18(24)17(12)23/h8,11,15,21,23-24H,5-7,9-10H2,1-4H3/t15-,20+/m0/s1
UniChem compound ID
97101352
1 reference
stated in
UniChem
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