Home
Random
Nearby
Log in
Settings
Donate
About Wikidata
Disclaimers
Search
(Q82231435)
Watch
English
S-Petasitin
chemical compound
In more languages
default for all languages
No label defined
No description defined
edit
Statements
instance of
type of chemical entity
0 references
subclass of
eremophilane sesquiterpenoid
0 references
mass
350.155180312
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₉H₂₆O₄S
0 references
canonical SMILES
O=C(OC1CCC2=CC(=O)C(=CC2(C)C1C)C(O)(C)C)C=CSC
0 references
isomeric SMILES
C[C@H]1[C@@H](CCC2=CC(=O)C(=C[C@]12C)C(C)(C)O)OC(=O)/C=C\SC
0 references
found in taxon
Petasites formosanus
3 references
stated in
Four new sesquiterpenes from Petasites formosanus
stated in
Four new sesquiterpenes from Petasites formosanus
stated in
Eremophilanes from Petasites formosanus KITAMURA.
Identifiers
InChI
InChI=1S/C19H26O4S/c1-12-16(23-17(21)8-9-24-5)7-6-13-10-15(20)14(18(2,3)22)11-19(12,13)4/h8-12,16,22H,6-7H2,1-5H3/b9-8-/t12-,16+,19+/m0/s1
0 references
InChIKey
SMMJMIYMTKDUOP-UIWQCLFSSA-N
0 references
CAS Registry Number
211691-00-8
0 references
PubChem CID
5471278
1 reference
matched by identifier from
InChIKey
InChIKey
SMMJMIYMTKDUOP-UIWQCLFSSA-N
UniChem compound ID
33547749
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID50420219
1 reference
matched by identifier from
InChIKey
InChIKey
SMMJMIYMTKDUOP-UIWQCLFSSA-N
DSSTOX compound identifier
DTXCID00371065
0 references
NSC number
710194
0 references
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