ID: 86899
SMILES:CC1(C)C2CCC(C)=CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 86900
SMILES:c1(CCCC(O)C)cc(O)c(C2CC(C(C)C)C=CN2C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 333.472
CB1 binding score: -14.028
InChIKey:BYBVVQZKNHRWPA-UHFFFAOYSA-N
ID: 86901
SMILES:CC1=CC2C(CC1)C(C)(C)Oc1cc(C)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 86902
SMILES:Oc1cc(CO)c2c(c1C(C)C)C1CC(C)=CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -15.383
InChIKey:DIANFWKGNRGTKW-UHFFFAOYSA-N
ID: 86903
SMILES:C(CC)Cc1cc(O)c2c(c1OC)OC(C)(C)C(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 280.364
CB1 binding score: -16.324
InChIKey:NOVBHLQFPBRZKC-UHFFFAOYSA-N
ID: 86904
SMILES:CC1=CC(c2c(O)cc(CCCCC)cc2O)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 86905
SMILES:CC(CC(=O)C1=C(O)C(C2OC(c3cc(C)cc(CCC)c3)=N2)C(C=C)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 381.516
CB1 binding score: -16.491
InChIKey:LXNXAHNNMMJOJA-UHFFFAOYSA-N
ID: 86906
SMILES:O(C)c1cc2c(c(CCCCC)c1C(=O)OC)c1c(cc2C)OC(C)(C)C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -16.585
InChIKey:UQNACRBAMSZKQP-UHFFFAOYSA-N
ID: 86907
SMILES:C(C)CCCc1c(C(O)CC)cc(O)c2c1OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -15.15
InChIKey:BIPHTBMUBBUQLR-UHFFFAOYSA-N
ID: 86908
SMILES:c1(C(NN)C(CO)=CCO)c(CCCCC)cc2c(c1O)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.616
CB1 binding score: -15.994
InChIKey:OCGFSPLNLHXKTG-UHFFFAOYSA-N
ID: 86909
SMILES:C1(C(=C)C)C(c2c(O)cc(CCCCC)cc2O)CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.129
InChIKey:ZTGXAWYVTLUPDT-UHFFFAOYSA-N
ID: 86910
SMILES:C1(Br)C(C)(C)Oc2cc(CCCCC)cc(O)c2C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 343.261
CB1 binding score: -17.061
InChIKey:CINLPKDSTQJRTO-UHFFFAOYSA-N
ID: 86911
SMILES:C1=C(C)C(O)=C2C3C(C(C)CCCC(C)C)=CC(C)C(C)C3CCC(=C)CC1O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.631
CB1 binding score: -13.959
InChIKey:PMWQGLNAYKDEIP-UHFFFAOYSA-N
ID: 86912
SMILES:C(CCCCc1ccc(C2CC(C)=CCC2C(=C)C)c(O)c1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.524
CB1 binding score: -16.298
InChIKey:FXDIUSURDGQHDQ-UHFFFAOYSA-N
ID: 86913
SMILES:c1(CC=C(C)C)cc(O)c(C2C=C(C)CCC2C(O)(C)C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.502
InChIKey:QTPKVTXMTKGMSZ-UHFFFAOYSA-N
ID: 86914
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)-c2c1cc(OC)c(C)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -18.805
InChIKey:FPNAYBZLIGJJAV-UHFFFAOYSA-N
ID: 86915
SMILES:O=C(OCC12OC3C(C=C1C)c1c(cc(CCCCC)cc1O)OC(C)(C)C3CC2)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.677
CB1 binding score: -13.485
InChIKey:GPCNLHTZGTZMEV-UHFFFAOYSA-N
ID: 86916
SMILES:Oc1c(C(CC(C)C)=O)c2c(c(OC)c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.729
InChIKey:JJZUDLKLXVHDEZ-UHFFFAOYSA-N
ID: 86917
SMILES:c1(C2C=C(C)CC(c3cc(CCN(C)C)ccc3OC)C2C(C)C)c(O)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 493.732
CB1 binding score: -14.203
InChIKey:AHMOFHUOIXXSOD-UHFFFAOYSA-N
ID: 86918
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(C(C)(C)O2)OC(C)(C)C2C1=CC(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -13.858
InChIKey:VLLFTEGFUMZUHV-UHFFFAOYSA-N
ID: 86919
SMILES:C(CCCC)Cc1cc2c(c(OC)c1)CC1C(=C)C(O)CCC1(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -15.251
InChIKey:KCLBWAQDUAXFDR-UHFFFAOYSA-N