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luzonial A

PropertiesImage
MNX_IDMNXM106336 Image of MNXM106336
referencechebi:66598
formulaC19H20O7
global charge0
mol weight360.362
InChIKeyHJTBDPQCVMXWMZ-AQSJNEJESA-N
InChIInChI=1S/C19H20O7/c1-11(9-20)14-8-15(19(24)10-25-18(23)17(14)19)26-16(22)7-4-12-2-5-13(21)6-3-12/h2-7,9,14-15,17-18,21,23-24H,1,8,10H2/b7-4+/t14-,15+,17-,18+,19+/m1/s1
SMILESC=C(C=O)[C@H]1C[C@H](OC(=O)/C=C/C2=CC=C(O)C=C2)[C@@]2(O)CO[C@H](O)[C@@H]12
MNX internals
InChI (mnx)InChI=1/C19H20O7/c1-11(9-20)14-8-15(19(24)10-25-18(23)17(14)19)26-16(22)7-4-12-2-5-13(21)6-3-12/h2-7,9,14-15,17-18,21,23-24H,1,8,10H2/b7-4+/t14-,15+,17-,18+,19+/m1/s1 Image of MNXM106336
SMILES (mnx)[CH2:1]=[C:11]([CH:9]=[O:20])[C@H:14]1[CH2:8][C@H:15]([O:26][C:16](/[CH:7]=[CH:4]/[C:12]2=[CH:3][CH:6]=[C:13]([OH:21])[CH:5]=[CH:2]2)=[O:22])[C@@:19]2([OH:24])[CH2:10][O:25][C@H:18]([OH:23])[C@@H:17]12
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:66598
chebi:66598
HJTBDPQCVMXWMZ-AQSJNEJESA-N 		luzonial A
(1S,3aS,4S,6S,6aS)-1,3a-dihydroxy-6-(3-oxoprop-1-en-2-yl)hexahydro-1H-cyclopenta[c]furan-4-yl (2E)-3-(4-hydroxyphenyl)prop-2-enoate