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(Q104965400)
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English
14alpha-Hydroxy-3,6-didemethylisotylocrebrine
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
4,7-Dimethoxy-9,11,12,13,13a,14-hexahydrophenanthro[9,10-f]indolizine-3,6,14-triol
1 reference
based on heuristic
inferred from SMILES
mass
381.157622836
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₂H₂₃NO₅
0 references
canonical SMILES
OC=1C=CC=2C(C1OC)=C3C=C(O)C(OC)=CC3=C4C2C(O)C5N(C4)CCC5
0 references
isomeric SMILES
COc1cc2c3c(c4ccc(O)c(OC)c4c2cc1O)[C@H](O)[C@@H]1CCCN1C3
0 references
found in taxon
Vincetoxicum tanakae
1 reference
stated in
Further investigation of phenanthroindolizidine alkaloids from Tylophora tanakae
Identifiers
InChI
InChI=1S/C22H23NO5/c1-27-18-9-12-13(8-17(18)25)20-11(5-6-16(24)22(20)28-2)19-14(12)10-23-7-3-4-15(23)21(19)26/h5-6,8-9,15,21,24-26H,3-4,7,10H2,1-2H3/t15-,21+/m0/s1
0 references
InChIKey
CMYVLWHAFMMTBU-YCRPNKLZSA-N
0 references
PubChem CID
10691250
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CMYVLWHAFMMTBU-YCRPNKLZSA-N
UniChem compound ID
33309500
1 reference
stated in
UniChem
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