ID: 127744
SMILES:O1c2c(c(O)c(C(=O)O)c(CCCCC)c2)C2C(C)(C)C1C2(O)CCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -15.518
InChIKey:MCLPIRFQITZRMW-UHFFFAOYSA-N
ID: 127745
SMILES:C1(C)(C)Oc2c(c(O)cc(C(O)CCCCC)c2)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.392
CB1 binding score: -16.575
InChIKey:PRINCRFMJGWSMN-UHFFFAOYSA-N
ID: 127746
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C1(C)C1(CC=C(C)CC1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.367
InChIKey:WHBMDXQBDBTSBI-UHFFFAOYSA-N
ID: 127747
SMILES:O1C(C=CC=C(C)C)(C)C=Cc2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.748
InChIKey:BHLPHFGVAHZWTN-UHFFFAOYSA-N
ID: 127748
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C(C)(CCC=C(C)C)Oc3ccc(O)c(c32)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.564
CB1 binding score: -15.065
InChIKey:LUXKUIOVPPDLFV-UHFFFAOYSA-N
ID: 127749
SMILES:C1(=O)CC2C(C)(C)Oc3cc(CCCCC)ccc3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -17.092
InChIKey:AELDXMGUHSKFSG-UHFFFAOYSA-N
ID: 127750
SMILES:CC1=CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 127751
SMILES:C1C2C(CC1(C)COC(=O)c1ccccc1)C(C)(C)Oc1ccc(CCCCC)cc12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.593
CB1 binding score: -14.872
InChIKey:ODPXVBGYTWJBFZ-UHFFFAOYSA-N
ID: 127752
SMILES:C1CC(C)=CC(c2c(O)ccc(O)c2)C1C(CCC=C(C)C)(C)OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.417
InChIKey:GOYPRJRDAYDXNP-UHFFFAOYSA-N
ID: 127753
SMILES:Oc1c(CC=C(C)C)c(CC=CCC)cc(O)c1C1C=C(C)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -11.465
InChIKey:WJYZCSZLTXWWOP-UHFFFAOYSA-N
ID: 127754
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: 127755
SMILES:C1(O)C(C)(C)Oc2cc(CCCCC)cc(O)c2C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -19.729
InChIKey:GIIVGKMZIUKMMN-UHFFFAOYSA-N
ID: 127756
SMILES:CCCc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -15.332
InChIKey:CZCJEHNYZWIYLW-UHFFFAOYSA-N
ID: 127757
SMILES:C(C=C(C)C)C12c3cc(CCCCC)cc(O)c3C3=C(C(C(C)C)CC2)C1C(=O)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.582
CB1 binding score: -14.204
InChIKey:BJHZCDHMIDDZFB-UHFFFAOYSA-N
ID: 127758
SMILES:C(CC)CCc1cc2c(c(O)c1)C1CC(=O)C2C(C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -15.929
InChIKey:WCVBRKURGLTPSV-UHFFFAOYSA-N
ID: 127759
SMILES:C(=C)(C1C(c2c(O)cc(C(O)C(C)CC)c(O)c2C)CC2C(C)(O2)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -16.849
InChIKey:WTOFYHWFTKFOOK-UHFFFAOYSA-N
ID: 127760
SMILES:C1(C)=CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.186
InChIKey:KQQMZTULVOWZJR-UHFFFAOYSA-N
ID: 127761
SMILES:c1c(C2C(C(C)=C)CCC(C)=C2)c(O)ccc1OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.401
InChIKey:YRXZLRWBEYIBHE-UHFFFAOYSA-N
ID: 127762
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(CC(O)C(CO)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.967
InChIKey:XTDYIISRNODHHT-UHFFFAOYSA-N
ID: 127763
SMILES:C(=CCc1c(O)cc(CCCCC)cc1O)(CCCC(=CC(CC(C)C)=O)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -18.028
InChIKey:QMGZTCUUXQTHRD-UHFFFAOYSA-N
ID: 127764
SMILES:C(=C(C)C)CCC1(C)Oc2c(c(O)cc(CCCCC)c2)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N