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Hapalindole D
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
3-(3-ethenyl-2-isothiocyanato-3-methyl-6-prop-1-en-2-ylcyclohexyl)-1H-indole
1 reference
based on heuristic
inferred from SMILES
mass
336.166019768
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
Hapalindole Q
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
12-epi-Hapalindole D isothiocyanate
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
Hapalindole D
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₁H₂₄N₂S
0 references
canonical SMILES
S=C=NC1C(C2=CNC=3C=CC=CC32)C(C(=C)C)CCC1(C=C)C
0 references
isomeric SMILES
C=C[C@@]1(C)CC[C@H](C(=C)C)[C@@H](c2c[nH]c3ccccc23)[C@H]1N=C=S
0 references
found in taxon
Hapalosiphon delicatulus
2 references
stated in
Isolation of a nitrile-containing indole alkaloid from the terrestrial blue-green alga hapalosiphon delicatulus
stated in
Isolation of a nitrile-containing indole alkaloid from the terrestrial blue-green alga hapalosiphon delicatulus
Hapalosiphon fontinalis
1 reference
stated in
Hapalindoles, antibacterial and antimycotic alkaloids from the cyanophyte Hapalosiphon fontinalis
Hapalosiphon pumilus
1 reference
stated in
Hapalindoles, antibacterial and antimycotic alkaloids from the cyanophyte Hapalosiphon fontinalis
Identifiers
InChI
InChI=1S/C21H24N2S/c1-5-21(4)11-10-15(14(2)3)19(20(21)23-13-24)17-12-22-18-9-7-6-8-16(17)18/h5-9,12,15,19-20,22H,1-2,10-11H2,3-4H3/t15-,19+,20-,21+/m1/s1
0 references
InChIKey
PPHWDUZMWNUINO-QAJUQPOASA-N
0 references
PubChem CID
14157132
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
ChEBI ID
180982
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C21H24N2S/c1-5-21(4)11-10-15(14(2)3)19(20(21)23-13-24)17-12-22-18-9-7-6-8-16(17)18/h5-9,12,15,19-20,22H,1-2,10-11H2,3-4H3/t15-,19+,20-,21+/m1/s1
UniChem compound ID
45865168
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID701046117
1 reference
matched by identifier from
InChIKey
InChIKey
PPHWDUZMWNUINO-QAJUQPOASA-N
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