ID: 125203
SMILES:Oc1c(O)c2c(cc1CCCCC)OC(C)(C)C1=C2C(=O)C(C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -12.36
InChIKey:KLPRYIHPOIQYGN-UHFFFAOYSA-N
ID: 125204
SMILES:c12c3c(c(O)cc1C)OC(C)(C)C1CC(C(C)=C)C(C32)C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.288
InChIKey:NHGJIKWRBRHXCY-UHFFFAOYSA-N
ID: 125205
SMILES:C(CCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 125206
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 125207
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(C)C1C2=CC(C)C=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -17.676
InChIKey:RBPFEWHJWJOSBE-UHFFFAOYSA-N
ID: 125208
SMILES:C12C(O)=C(C)CC1c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -15.411
InChIKey:UPQIYFROWZNZAR-UHFFFAOYSA-N
ID: 125209
SMILES:C(CCCC)c1cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 125210
SMILES:c1c(C)cc2c(c1)C(C)(C)Oc1c-2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 125211
SMILES:O=C(C)C1=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.521
InChIKey:SHIKKRGGQNIBFN-UHFFFAOYSA-N
ID: 125212
SMILES:C1(c2ccc(O)cc2)Oc2cc(CCCCC)cc(O)c2CC1C(C)=C
Pathway: Polyketides;Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.474
CB1 binding score: -16.622
InChIKey:DKCLYKCIIOLJMP-UHFFFAOYSA-N
ID: 125213
SMILES:Cc1c(CC=C(CO)CCC=C(C)C)c(O)cc(CCC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -13.911
InChIKey:YSBFQOQEZUPJAB-UHFFFAOYSA-N
ID: 125214
SMILES:C(C(C)=CCCC1C2C(OC1=O)O2)CC(C)=CCc1c(OC)c(C)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -15.58
InChIKey:FYYWKOTUBHUHOK-UHFFFAOYSA-N
ID: 125215
SMILES:C1CC(C(C)(O)C)C(c2c(O)cc(CCC)cc2O)C=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -19.168
InChIKey:BMEOABJGGIYLGA-UHFFFAOYSA-N
ID: 125216
SMILES:C1(O)Oc2c(ccc(O)c2)C12CCC(C)=CCC1C2C(=O)OC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.407
CB1 binding score: -15.288
InChIKey:DKUJDOWMFZNHHI-UHFFFAOYSA-N
ID: 125217
SMILES:C(C)(CO)(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O)OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -12.993
InChIKey:VUMNHZFCEXWHPW-UHFFFAOYSA-N
ID: 125218
SMILES:c1(O)cc(C2C(C(C)=C)CCC(C)=C2)c(O)cc1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.048
InChIKey:FUZJMTMPVZRGQF-UHFFFAOYSA-N
ID: 125219
SMILES:c1c(O)c(C2C=C(C)CCC2C(C)=C)c(O)cc1CC=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -19.892
InChIKey:IHDZBQSJFRBIMW-UHFFFAOYSA-N
ID: 125220
SMILES:C1(C(C)C)CC(=O)C2(C)Oc3cc(CCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: Not available
InChIKey:QGMRKUQLDYWNNR-UHFFFAOYSA-N
ID: 125221
SMILES:C1=C(O)C(=O)c2c3c(c(OC(C)=O)cc2C)C(CO)(C)OC12C(C)CCC2C(C)(C)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.497
CB1 binding score: -15.355
InChIKey:SKQXFSDIJYDTMH-UHFFFAOYSA-N
ID: 125222
SMILES:C12C(OO)(C)C=CC1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -16.402
InChIKey:VPZKFMWXAWUKOE-UHFFFAOYSA-N
ID: 125223
SMILES:C1=C(C)CC(c2c(O)cc(CC=C(CCC=C(C)C)C)c(O)c2)C(=O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -15.635
InChIKey:XTDCQXJVATWYJP-UHFFFAOYSA-N