MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks
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The Swiss Initiative in Systems Biology
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neoabietadienol
Properties
Image
Occurences in reactions
MNX_ID
MNXM165011
#reac
in my sandbox
0
in MNXref (generic)
16
in models (compartimentalized)
0
formula
C
20
H
32
O
charge
0
mass
288.24532
reference
metacycM:CPD-8709
InChIKey
MUBMRBNHMHINMF-UMQXSMKFSA-N
InChI
InChI=1S/C20H32O/c1-14(2)15-6-8-17-16(12-15)7-9-18-19(3,13-21)10-5-11-20(17,18)4/h12,17-18,21H,5-11,13H2,1-4H3/t17-,18?,19-,20+/m0/s1
SMILES
CC(C)=C1C=C2CCC3[C@](C)(CO)CCC[C@]3(C)[C@H]2CC1
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
Identifier
Description
metacyc.compound:CPD-8709
metacycM:CPD-8709
seed.compound:cpd25391
seedM:cpd25391
neoabietadienol
seedM:M_cpd25391
secondary/obsolete/fantasy identifier