MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

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(+)-alpha-santalene

MNXM4139 is deprecated and here replaced by MNXM735743
!!! Alternative mappings exist !!!

	Properties	Image
MNX_ID	MNXM735743
reference	chebi:61677
formula	C₁₅H₂₄
global charge	0
mol weight	204.357
InChIKey	KWFJIXPIFLVMPM-PFNKYVCDSA-N
InChI	InChI=1S/C15H24/c1-10(2)6-5-7-14(3)11-8-12-13(9-11)15(12,14)4/h6,11-13H,5,7-9H2,1-4H3/t11-,12+,13-,14-,15?/m1/s1
SMILES	CC(C)=CCC[C@]1(C)[C@H]2C[C@@H]3[C@H](C2)[C@@]31C

MNX internals

InChI (mnx)	InChI=1/C15H24/c1-10(2)6-5-7-14(3)11-8-12-13(9-11)15(12,14)4/h6,11-13H,5,7-9H2,1-4H3/t11-,12+,13-,14-,15?/m1/s1
SMILES (mnx)	[CH3:1][C:10]([CH3:2])=[CH:6][CH2:5][CH2:7][C@:14]1([CH3:3])[C@@H:11]2[CH2:8][C@H:12]3[C@@H:13]([CH2:9]2)[C:15]31[CH3:4]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	3
in models (compartimentalized)	0

Similar chemical compounds in external resources
Identifier	Description
CHEBI:61677 chebi:61677 KWFJIXPIFLVMPM-PFNKYVCDSA-N	(+)-alpha-santalene (1S,2R,4S,6R,7R)-1,7-dimethyl-7-(4-methylpent-3-en-1-yl)tricyclo[2.2.1.0(2,6)]heptane alpha-santalene
kegg.compound:C19736 keggC:C19736 KWFJIXPIFLVMPM-PFNKYVCDSA-N	(+)-alpha-Santalene
seed.compound:cpd20983 seedM:cpd20983 KWFJIXPIFLVMPM-PFNKYVCDSA-N	(+)-alpha-Santalene (+)-alpha-santalene
metacyc.compound:CPD-11377 metacycM:CPD-11377 KWFJIXPIFLVMPM-PFNKYVCDSA-N	(+)-alpha-santalene
hmdb:HMDB0034939 KWFJIXPIFLVMPM-PFNKYVCDSA-N	alpha-Santalene (-)-alpha -Santalene 1,7-dimethyl-7-(4-methylpent-3-en-1-yl)tricyclo[2.2.1.0²,⁶]heptane Hexaphenyl-cyclotrisiloxane Santalen Santalene a-Santalene alpha -Santalene alpha-santalene beta-Santalene
hmdb:HMDB34939 keggC:M_C19736 seedM:M_cpd20983	secondary/obsolete/fantasy identifier