Home
Random
Nearby
Log in
Settings
Donate
About Wikidata
Disclaimers
Search
(Q105252807)
Watch
English
Caesalpinine A
chemical compound
In more languages
edit
Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
421.236541852
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₅H₃₁N₃O₃
0 references
canonical SMILES
O=C1CC(c2ccccc2)NCCCCN2CC(CN1)C(C(O)c1ccccc1)C2=O
0 references
isomeric SMILES
O=C1C[C@H](c2ccccc2)NCCCCN2C[C@H](CN1)[C@H]([C@H](O)c1ccccc1)C2=O
0 references
found in taxon
Moullava digyna
1 reference
stated in
Structure of caesalpinine A: a novel spermidine alkaloid from Caesalpinia digyna Rottl
Identifiers
InChI
InChI=1S/C25H31N3O3/c29-22-15-21(18-9-3-1-4-10-18)26-13-7-8-14-28-17-20(16-27-22)23(25(28)31)24(30)19-11-5-2-6-12-19/h1-6,9-12,20-21,23-24,26,30H,7-8,13-17H2,(H,27,29)/t20-,21+,23+,24+/m0/s1
0 references
InChIKey
SHBCCFGHZDXOET-XWVZOOPGSA-N
0 references
PubChem CID
5458904
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
SHBCCFGHZDXOET-XWVZOOPGSA-N
UniChem compound ID
53029670
1 reference
stated in
UniChem
Sitelinks
Wikipedia
(0 entries)
edit
Wikibooks
(0 entries)
edit
Wikinews
(0 entries)
edit
Wikiquote
(0 entries)
edit
Wikisource
(0 entries)
edit
Wikiversity
(0 entries)
edit
Wikivoyage
(0 entries)
edit
Wiktionary
(0 entries)
edit
Multilingual sites
(0 entries)
edit