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(E,E)-epoxyfarnesyl-5,7-dihydroxy-4,6-dimethylphthalide

MNXM148235 is deprecated and here replaced by MNXM1368232
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1368232 Image of MNXM1368232
referencechebi:232431
formulaC25H33O5
global charge-1
mol weight413.534
InChIKeyLMEWWPPVVWLMGE-AWVRYUGRSA-M
InChIInChI=1S/C25H34O5/c1-15(10-11-19-24(4,5)30-19)8-7-9-16(2)12-13-25(6)18-14-29-23(28)20(18)21(26)17(3)22(25)27/h8,12,19,26H,7,9-11,13-14H2,1-6H3/p-1/b15-8+,16-12+/t19-,25+/m0/s1
SMILESCC1=C([O-])C2=C(COC2=O)[C@@](C)(C/C=C(\C)CC/C=C(\C)CC[C@@H]2OC2(C)C)C1=O
MNX internals
InChI (mnx)InChI=1/C25H34O5/c1-15(10-11-19-24(4,5)30-19)8-7-9-16(2)12-13-25(6)18-14-29-23(28)20(18)21(26)17(3)22(25)27/h8,12,19,26H,7,9-11,13-14H2,1-6H3/b15-8+,16-12+/t19-,25+/m0/s1 Image of MNXM1368232
SMILES (mnx)[CH3:1]/[C:15](=[CH:8]\[CH2:7][CH2:9]/[C:16]([CH3:2])=[CH:12]/[CH2:13][C@:25]1([CH3:6])[C:18]2=[C:20]([C:21]([OH:26])=[C:17]([CH3:3])[C:22]1=[O:27])[C:23](=[O:28])[O:29][CH2:14]2)[CH2:10][CH2:11][C@H:19]1[C:24]([CH3:4])([CH3:5])[O:30]1
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
IdentifierDescription

CHEBI:232431
chebi:232431
LMEWWPPVVWLMGE-AWVRYUGRSA-M 		(E,E)-epoxyfarnesyl-5,7-dihydroxy-4,6-dimethylphthalide
(E,E)-epoxyfarnesyl-5,7-dihydroxy-4,6-dimethylphthalide(1-)

metacyc.compound:CPD-17325
metacycM:CPD-17325
LMEWWPPVVWLMGE-AWVRYUGRSA-N 		epoxyfarnesyl-5,7-dihydroxy-4,6-dimethylphthalide