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ent-kaur-15-en-17,19-dioate

PropertiesImageOccurences in reactions
MNX_IDMNXM1372541Image of MNXM1372541
#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
formulaC20H26O4
charge-2
mass330.424
referenceseedM:cpd23926
InChIKeyYQNLDLVKFNZFTI-FMSVMPKNSA-L
InChIInChI=1S/C20H28O4/c1-18-7-3-8-19(2,17(23)24)14(18)6-9-20-10-12(4-5-15(18)20)13(11-20)16(21)22/h11-12,14-15H,3-10H2,1-2H3,(H,21,22)(H,23,24)/p-2/t12-,14?,15?,18-,19-,20+/m1/s1
SMILES[CH3:1][C@@:18]12[CH2:7][CH2:3][CH2:8][C@@:19]([CH3:2])([C:17](=[O:23])[OH:24])[CH:14]1[CH2:6][CH2:9][C@@:20]13[CH2:10][C@@H:12]([CH2:4][CH2:5][CH:15]21)[C:13]([C:16](=[O:21])[OH:22])=[CH:11]3
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Similar chemical compounds in external resources
IdentifierDescription
seed.compound:cpd23926
seedM:cpd23926
ent-kaur-15-en-17,19-dioate
kauralexin B2
seedM:M_cpd23926 secondary/obsolete/fantasy identifier