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(Q67880018)
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English
neophytadiene
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
phytane diterpenoid
0 references
phytane diterpene
0 references
mass
278.297351216
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₃₈
0 references
canonical SMILES
CC(C)CCCC(C)CCCC(C)CCCC(=C)C=C
0 references
found in taxon
Culcitium canescens
1 reference
stated in
Furanoeremophilanes and other constituents from Senecio Canescens
Tagetes lucida
1 reference
stated in
Constituents ofTagetes lucida Cav. ssp.lucida Essential Oil
Abies pinsapo subsp. marocana
1 reference
stated in
Diterpenoids and cyclolanostanolides from Abies marocana
Allium ampeloprasum
1 reference
stated in
Volatile Compounds in Leek and Asafoetida
Anethum graveolens
1 reference
stated in
Constituents of Dill (Anethum graveolensL.) with Sensory Importance
Bellis perennis
1 reference
stated in
Acetylenes and terpenoids of Bellis perennis
Cedronella canariensis
1 reference
stated in
Chavicol β-d-glucoside, a phenylpropanoid heteroside, benzyl-β-d-glucoside and glycosidically bound volatiles from subspecies of Cedronella canariensis
Senecio doria
1 reference
stated in
Furoeremophilanes and related compounds from Senecio pachyphyllos
Glehnia littoralis
1 reference
stated in
Comparison of the essential oils of Glehnia littoralis from Northern and Southern Japan
Identifiers
InChI
InChI=1S/C20H38/c1-7-18(4)12-9-14-20(6)16-10-15-19(5)13-8-11-17(2)3/h7,17,19-20H,1,4,8-16H2,2-3,5-6H3
0 references
InChIKey
NIDGCIPAMWNKOA-UHFFFAOYSA-N
0 references
CAS Registry Number
504-96-1
0 references
PubChem CID
10446
0 references
ChEBI ID
145817
mapping relation type
exact match
2 references
stated in
ChEBI release 2021-03-01
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C20H38/c1-7-18(4)12-9-14-20(6)16-10-15-19(5)13-8-11-17(2)3/h7,17,19-20H,1,4,8-16H2,2-3,5-6H3
UniChem compound ID
23646193
1 reference
stated in
UniChem
MassBank accession ID
MSBNK-Fac_Eng_Univ_Tokyo-JP009938
0 references
HSDB ID
4321
1 reference
stated in
Hazardous Substances Data Bank
HSDB ID
4321
publication date
28 October 2019
title
NEOPHYTADIENE
(English)
retrieved
10 May 2021
DSSTox substance ID
DTXSID40964657
1 reference
matched by identifier from
InChIKey
InChIKey
NIDGCIPAMWNKOA-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID401392349
0 references
Cannabis Database ID
005831
1 reference
stated in
Cannabis Database
Human Metabolome Database ID
HMDB0302243
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
NIDGCIPAMWNKOA-UHFFFAOYSA-N
UNII
HL3QFB56FB
1 reference
matched by identifier from
InChIKey
InChIKey
NIDGCIPAMWNKOA-UHFFFAOYSA-N
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