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7-Acetylrinderine
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
[(7R)-7-acetyloxy-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl 2-hydroxy-2-[(1S)-1-hydroxyethyl]-3-methylbutanoate
1 reference
based on heuristic
inferred from SMILES
3'-Acetyllycopsamine
1 reference
based on heuristic
inferred from SMILES
mass
341.183837584
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
Acetylintermedine
1 reference
based on heuristic
inferred from InChI
Acetyllycopsamine
1 reference
based on heuristic
inferred from InChI
7-O-Acetylechinatine
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₇H₂₇NO₆
0 references
canonical SMILES
O=C(OC1CCN2CC=C(COC(=O)C(O)(C(O)C)C(C)C)C21)C
0 references
isomeric SMILES
CC(=O)O[C@H]1CCN2CC=C(COC(=O)[C@](O)(C(C)C)[C@@H](C)O)[C@H]12
0 references
found in taxon
Eupatorium fortunei
1 reference
stated in
Pyrrolizidine alkaloids from eupatorium fortunei
Identifiers
InChI
InChI=1S/C17H27NO6/c1-10(2)17(22,11(3)19)16(21)23-9-13-5-7-18-8-6-14(15(13)18)24-12(4)20/h5,10-11,14-15,19,22H,6-9H2,1-4H3/t11-,14+,15-,17+/m1/s1
0 references
InChIKey
RKDOFSJTBIDAHX-MVQRFQBOSA-N
0 references
CAS Registry Number
56317-18-1
1 reference
InChIKey
RKDOFSJTBIDAHX-MVQRFQBOSA-N
stated in
CAS Common Chemistry
retrieved
9 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=56317-18-1
PubChem CID
185847
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
RKDOFSJTBIDAHX-MVQRFQBOSA-N
UniChem compound ID
19086488
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID80971749
1 reference
matched by identifier from
InChIKey
InChIKey
RKDOFSJTBIDAHX-MVQRFQBOSA-N
DSSTOX compound identifier
DTXCID601399246
0 references
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