ID: 60103
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: 60104
SMILES:O1c2c(O)cc(CCCCC)cc2C2C(CC(C(C)=C)CC=C(C)C2)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -15.465
InChIKey:UABQCWBBDKVDGC-UHFFFAOYSA-N
ID: 60105
SMILES:c1(CCCCC)cc2c(c(O)c1C(=O)CC(C)C)OC(C)(C)c1c2cc(C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.555
CB1 binding score: -15.747
InChIKey:RHNHJHTVNWKNTG-UHFFFAOYSA-N
ID: 60106
SMILES:C(OC(=O)C)C1OC(Oc2c(CC=C(CCC=C(C)C)C)cc(O)cc2CCCCC)C(O)C(O)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 520.663
CB1 binding score: -14.928
InChIKey:BUAXEHAHDXGQTP-UHFFFAOYSA-N
ID: 60107
SMILES:CC12CCC(C(C)CCC=C(C)C)C1c1c(cc(CCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -13.967
InChIKey:BTHWBVMTINRDGW-UHFFFAOYSA-N
ID: 60108
SMILES:O(C(C)=O)CC1CCC(C(C)=C)C(c2c(O)cc(CCCCC)cc2O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -16.753
InChIKey:FGJYATLMLZJXEF-UHFFFAOYSA-N
ID: 60109
SMILES:C(c1cc2c(c(O)c1)C1C(CCC(CO)=C1)C(C)(C)O2)(C)C=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -15.953
InChIKey:QTUASFXLGSWDTC-UHFFFAOYSA-N
ID: 60110
SMILES:C1(C)(C)C(Oc2cc(CCCCC)ccc2O)CC(C)=CCCC(C)=CCC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -16.655
InChIKey:QPDFJGSDGWBKQF-UHFFFAOYSA-N
ID: 60111
SMILES:C1C(C)C(c2c(O)cccc2)C(C=C(CCCC)C)C(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -13.667
InChIKey:HIQLSMOLRZEPCF-UHFFFAOYSA-N
ID: 60112
SMILES:c1c(O)cc2c(c1)C(C)(CCC1(C)CCC(O)C(C)(C)O1)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.402
CB1 binding score: -10.966
InChIKey:GBJWLFQMUAKPEP-UHFFFAOYSA-N
ID: 60113
SMILES:O1c2cc(CCCCC)cc(O)c2C2C(O)C1(O)C(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 308.374
CB1 binding score: -15.026
InChIKey:OXFIZAPEVYRLNE-UHFFFAOYSA-N
ID: 60114
SMILES:Oc1c(CC=C(C)CCC=C(C)CCC=C(C)C)c(O)cc(CCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 356.55
CB1 binding score: -18.934
InChIKey:LDZQKZLPWVBJOB-UHFFFAOYSA-N
ID: 60115
SMILES:C1(O)c2c(cc(CCCCC)cc2O)OC(C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -19.442
InChIKey:FRBSLGKYEBNHLH-UHFFFAOYSA-N
ID: 60116
SMILES:O1c2cc(CCCC(=O)O)cc(O)c2C2C1(C)OCC2CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -15.374
InChIKey:YFCJYEDASFBWBS-UHFFFAOYSA-N
ID: 60117
SMILES:C1(C(C)C)(O)C2CCC(C)=CC2c2c(O)cc(CCCC(CC)C)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -11.712
InChIKey:FBRVCKZOBHBQGB-UHFFFAOYSA-N
ID: 60118
SMILES:C(CCCCc1cc(O)c2c(c1)OC(C)(C)C1=C2C(O)C(C)(O)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.723
InChIKey:TWMARAAMRBHEFT-UHFFFAOYSA-N
ID: 60119
SMILES:Oc1cc(CCCCC)cc2c1C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 60120
SMILES:C1CC(C)C(=O)C2C1C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.597
InChIKey:LQROZGZXFUAWIS-UHFFFAOYSA-N
ID: 60121
SMILES:C1(C)=CC2c3c(cc(CCCCC)cc3OC(=O)C=Cc3ccccc3)OC(C(C)(O)C)C2OC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 476.613
CB1 binding score: -15.054
InChIKey:ORWSFUZLMBRTPA-UHFFFAOYSA-N
ID: 60122
SMILES:C(C)CCCc1cc(O)cc2c1CC(O)C1(O)C(C)(CCC(CCC=C(C)C)=CC1)C2=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.624
CB1 binding score: -15.559
InChIKey:WBBAMOBHUFIQSP-UHFFFAOYSA-N
ID: 60123
SMILES:Oc1c(C)c(O)c2c(c1CC=C(CCC=C(C)C)C)OC(C)(C)C1C2C=C(C(=O)O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.58
CB1 binding score: -16.976
InChIKey:HRIRFAOJJUCORV-UHFFFAOYSA-N