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(+)-phytocassane A

MNXM680583 is deprecated and here replaced by MNXM739386
!!! Alternative mappings exist !!!
PropertiesImageOccurences in reactions
MNX_IDMNXM739386Image of MNXM739386
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC20H28O3
charge0
mass316.20384
referencechebi:72664
InChIKeyXVEOIKIXOSKAFL-BJASISCMSA-N
InChIInChI=1S/C20H28O3/c1-6-12-9-14(21)17-13(11(12)2)7-8-16-19(3,4)18(23)15(22)10-20(16,17)5/h6,9,11,13,15-17,22H,1,7-8,10H2,2-5H3/t11-,13-,15-,16-,17+,20-/m1/s1
SMILESC=CC1=CC(=O)[C@@H]2[C@H](CC[C@@H]3C(C)(C)C(=O)[C@H](O)C[C@]32C)[C@@H]1C
Parent-child relations graph
 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
CHEBI:72664
chebi:72664 		(+)-phytocassane A
(2alpha,5beta,8alpha,9beta,10alpha,14beta)-2-hydroxy-14-methyl-13-vinylpodocarp-12-ene-3,11-dione
(3R,4aR,4bR,8S,8aR,10aS)-3-hydroxy-1,1,4a,8-tetramethyl-7-vinyl-1,3,4,4a,4b,8,8a,9,10,10a-decahydrophenanthrene-2,5-dione
2alpha-hydroxy-14beta-methyl-13-vinyl-5beta,8alpha,9beta,10alpha-podocarp-12-ene-3,11-dione
ent-2beta-hydroxy-12,15-cassadiene-3,11-dione
phytocassane A
hmdb:HMDB0041056 Phytocassane A
(-)-Phytocassane a
7-ethenyl-3-hydroxy-1,1,4a,8-tetramethyl-1,2,3,4,4a,4b,5,8,8a,9,10,10a-dodecahydrophenanthrene-2,5-dione
7-ethenyl-3-hydroxy-1,1,4a,8-tetramethyl-3,4,4b,8,8a,9,10,10a-octahydrophenanthrene-2,5-dione
metacyc.compound:CPD-7094
metacycM:CPD-7094
seed.compound:cpd24709
seedM:cpd24709 		phytocassane A
(2beta,14alpha)-2-hydroxy-14-methyl-13-vinylpodocarp-12-ene-3,11-dione
(3S,4aS,4bS,8R,8aS,10aR)-3-hydroxy-1,1,4a,8-tetramethyl-7-vinyl-1,3,4,4a,4b,8,8a,9,10,10a-decahydrophenanthrene-2,5-dione
2beta-hydroxy-12,15-cassadiene-3,11-dione
hmdb:HMDB41056
seedM:M_cpd24709 		secondary/obsolete/fantasy identifier