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(Q105369618)
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English
11-Isothiocyano-7bH-eudesm-5-ene [C16H25NS]
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
7-(2-isothiocyanatopropan-2-yl)-1,4a-dimethyl-2,3,4,5,6,7-hexahydro-1H-naphthalene
1 reference
based on heuristic
inferred from SMILES
mass
263.1707708
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₆H₂₅NS
0 references
canonical SMILES
S=C=NC(C)(C)C1C=C2C(C)CCCC2(C)CC1
0 references
isomeric SMILES
C[C@H]1CCC[C@]2(C)CC[C@H](C(C)(C)N=C=S)C=C12
0 references
found in taxon
Acanthella pulcherrima
1 reference
stated in
New Isothiocyanate Sesquiterpenes From the Australian Marine Sponge Acanthella pulcherrima
Axinella cannabina
1 reference
stated in
New nitrogenous sesquiterpenes based on alloaromadendrane and epi-eudesmane skeletons from the marine sponge Axinellacannabina
Axinyssa ambrosia
1 reference
stated in
New nitrogenous eudesmane-type compounds isolated from the Caribbean sponge Axinyssa ambrosia
Cadlina luteomarginata
1 reference
stated in
Acanthenes A to C: a chloro, isothiocyanate, formamide sesquiterpene triad isolated from the Northeastern Pacific marine sponge Acanthella sp. and the dorid nudibranch Cadlina luteomarginata
Identifiers
InChI
InChI=1S/C16H25NS/c1-12-6-5-8-16(4)9-7-13(10-14(12)16)15(2,3)17-11-18/h10,12-13H,5-9H2,1-4H3/t12-,13-,16+/m0/s1
0 references
InChIKey
YZYZKKAHYRXPMB-HEHGZKQESA-N
0 references
PubChem CID
9992945
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YZYZKKAHYRXPMB-HEHGZKQESA-N
UniChem compound ID
442524
1 reference
stated in
UniChem
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