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Sequiterpene Lactone 326

PropertiesImage
MNX_IDMNXM1129363 Image of MNXM1129363
referencechebi:173202
formulaC15H20O4
global charge0
mol weight264.321
InChIKeyJPWMRQZYTCWJHW-UHFFFAOYSA-N
InChIInChI=1S/C15H20O4/c1-8-6-11-10(9(2)13(17)19-11)7-14(3)12(16)4-5-15(8,14)18/h8,10-11,18H,2,4-7H2,1,3H3
SMILESC=C1C(=O)OC2CC(C)C3(O)CCC(=O)C3(C)CC12
MNX internals
InChI (mnx)InChI=1/C15H20O4/c1-8-6-11-10(9(2)13(17)19-11)7-14(3)12(16)4-5-15(8,14)18/h8,10-11,18H,2,4-7H2,1,3H3/t8?,10?,11?,14?,15? Image of MNXM1129363
SMILES (mnx)[CH3:1][CH:8]1[CH2:6][CH:11]2[CH:10]([CH2:7][C:14]3([CH3:3])[C:12](=[O:16])[CH2:4][CH2:5][C:15]13[OH:18])[C:9](=[CH2:2])[C:13](=[O:17])[O:19]2
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:173202
chebi:173202
JPWMRQZYTCWJHW-UHFFFAOYSA-N
Sequiterpene Lactone 326
5a-hydroxy-5,8a-dimethyl-1-methylidene-4,5,6,7,9,9a-hexahydro-3aH-azuleno[6,7-b]uran-2,8-dione