ID: 14743
SMILES:C12C(=CC(OC)(C)CC1)c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.247
InChIKey:YJMFMIQEDZMKKR-UHFFFAOYSA-N
ID: 14744
SMILES:c1(CCCCCC)cc(O)c(C2C(C(C)=C)CCC(C)=C2)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -18.043
InChIKey:AELQXIFXNIOWTC-UHFFFAOYSA-N
ID: 14745
SMILES:O1c2c(cc(CCCCC)cc2O)C(C)C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -12.752
InChIKey:ASTYMDNTAZQHEF-UHFFFAOYSA-N
ID: 14746
SMILES:C1CC(C(C)C)C(c2c(O)cc(CCCC)cc2O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -18.479
InChIKey:QHFVULIOBFWRAD-UHFFFAOYSA-N
ID: 14747
SMILES:C(=CCCC1(C)Oc2c(c(O)cc(CCCCC)c2)C=C1C(C)C)C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -14.463
InChIKey:LQGFUGFIYUTRGP-UHFFFAOYSA-N
ID: 14748
SMILES:O1C(Cl)C(CCC(C(C)=C)Br)c2c(O)cc(C)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 345.664
CB1 binding score: -15.494
InChIKey:UHCGJICGHNAMSA-UHFFFAOYSA-N
ID: 14749
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)CC1)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -17.909
InChIKey:LUYHZUJNWMSVCU-UHFFFAOYSA-N
ID: 14750
SMILES:C12C=C(C)CCC1C(C)(C)Oc1c2cc(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -20.067
InChIKey:OBJJEVJNCDBGOD-UHFFFAOYSA-N
ID: 14751
SMILES:Oc1cc(O)c2c(c1C(=O)C1CC(C)=CCC1C(C)=C)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.565
CB1 binding score: -16.73
InChIKey:FXPQQYSAVWFOTH-UHFFFAOYSA-N
ID: 14752
SMILES:C1C(c2c(O)cc(CCCCC)cc2O)C2C(C)(O2)CC=C1C(C)(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.918
InChIKey:CZUZHKSVGLGXPH-UHFFFAOYSA-N
ID: 14753
SMILES:c1(O)c2c(cc(O)c1CC(=CCCC(=CCO)C)O)OC(C)(C)C1C2C=C(C(OC)=O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.551
CB1 binding score: -14.686
InChIKey:ZRISZFOBMMSLJS-UHFFFAOYSA-N
ID: 14754
SMILES:c12cc(C)c(O)cc1-c1cc(C(=O)O)c(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.446
CB1 binding score: -15.467
InChIKey:CCCFSUSJUJADRC-UHFFFAOYSA-N
ID: 14755
SMILES:C1CCC2(OC2)c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -14.417
InChIKey:SMKHKEIRBQIBGV-UHFFFAOYSA-N
ID: 14756
SMILES:C12C=C(C)CCC1C(C)(C)Oc1c2c(O)cc(O)c1C(=O)C(C)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.453
InChIKey:NIZQVFOBIVYVBJ-UHFFFAOYSA-N
ID: 14757
SMILES:CC(C)C1CCC2(C)Oc3c(c(O)cc(CCCCC)c3)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.855
InChIKey:VBMSTUJNROPVAW-UHFFFAOYSA-N
ID: 14758
SMILES:C(C)CCCc1c(O)c2c(cc1)OC(CCC=C(C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.055
InChIKey:YNUMDHXFQAUOGS-UHFFFAOYSA-N
ID: 14759
SMILES:c1(O)c2c(c(CCCCC)cc1O)OC(C)(C)C1C2CC(C)(O)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -14.657
InChIKey:RKTOBOKOUAFKML-UHFFFAOYSA-N
ID: 14760
SMILES:Oc1c(CC=C(CCC=C(C)C)C)c(CCCCC)cc(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.891
InChIKey:JFJAMLJGMDJCRJ-UHFFFAOYSA-N
ID: 14761
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 14762
SMILES:Cc1ccc2c(c1)-c1c(cc(CCCCCO)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -16.031
InChIKey:MSIHCQAPVYVMLV-UHFFFAOYSA-N
ID: 14763
SMILES:c1c(C)c(C=O)c(O)c(C2C=C(C)CCC2C(=C)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -17.241
InChIKey:ZRENVVUZARSAET-UHFFFAOYSA-N