(Q105259520)

English

10-Isothiocyano-4-cadinene

chemical compound

In more languages

Statements

type of chemical entity

0 references

4-Isothiocyanato-4,7-dimethyl-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene

1 reference

based on heuristic

inferred from SMILES

263.1707708 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1R,6R,7S,10S)-10-Isothiocyanatocadin-4-ene

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(1S,4R,4aR,8aS)-4-isothiocyanato-4,7-dimethyl-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(1S,4S,4aR,8aS)-4-isothiocyanato-4,7-dimethyl-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene

1 reference

based on heuristic

inferred from InChI

(1R,4R,4aR,8aR)-4-isothiocyanato-4,7-dimethyl-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₆H₂₅NS

0 references

canonical SMILES

S=C=NC1(C)CCC(C(C)C)C2C=C(C)CCC21

0 references

isomeric SMILES

CC1=C[C@H]2[C@H](C(C)C)CC[C@@](C)(N=C=S)[C@@H]2CC1

0 references

Acanthella cavernosa

1 reference

New Isocyano and Isothiocyanato Terpene Metabolites from the Tropical Marine Sponge Acanthella cavernosa

Identifiers

InChI=1S/C16H25NS/c1-11(2)13-7-8-16(4,17-10-18)15-6-5-12(3)9-14(13)15/h9,11,13-15H,5-8H2,1-4H3/t13-,14-,15+,16+/m0/s1

0 references

SRYJMNDTUAKSRD-CAOSSQGBSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

UniChem compound ID

1 reference

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