ID: 61972
SMILES:O=C(C(=CCCC1(C)C2CCC(CC3=CC(=O)C=C(OC)C3=O)C(CC(C)C)C2c2c(O)cc(CCCCC)cc2O1)O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 606.8
CB1 binding score: -12.311
InChIKey:JCBJTLCWCKCBMB-UHFFFAOYSA-N
ID: 61973
SMILES:C(CCCC)Cc1cc2c(c(O)c1)C1CC(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -18.766
InChIKey:OKXUDFJPZMVBEH-UHFFFAOYSA-N
ID: 61974
SMILES:CC(OC(C)=O)C1CCC(C)=CCc2c(OC(C)=O)cc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -15.829
InChIKey:GQKQREXOWUWWGH-UHFFFAOYSA-N
ID: 61975
SMILES:C12c3c(cc(CCCCC)cc3O1)OC(C)(C)C1CCC(C)=C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -16.124
InChIKey:GALAYGWPJGQICH-UHFFFAOYSA-N
ID: 61976
SMILES:OC(C(c1cc2c(c(O)c1)C1=C(CC(C)(C)O1)C(C)(C)O2)C)CC(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 358.478
CB1 binding score: -15.77
InChIKey:VWKZGBWCWJQFRJ-UHFFFAOYSA-N
ID: 61977
SMILES:C=C(C1CC(C(=C)C)C(c2c(O)cc(CCCCC)cc2O)C(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -15.754
InChIKey:QTJQNZUCVWZIBM-UHFFFAOYSA-N
ID: 61978
SMILES:C1(COC(=O)C=Cc2ccccc2)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 460.614
CB1 binding score: -15.891
InChIKey:SABASPJBZYNQJJ-UHFFFAOYSA-N
ID: 61979
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.471
CB1 binding score: -19.804
InChIKey:VGBLUPCGCQUYRW-UHFFFAOYSA-N
ID: 61980
SMILES:C1C2C3C(OC(=O)C13)c1c(O)cc(C)cc1OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.316
CB1 binding score: -15.705
InChIKey:RXCSQMDREVFLBK-UHFFFAOYSA-N
ID: 61981
SMILES:C1C2C(C)(C)Oc3c(c(O)ccc3)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 190.242
CB1 binding score: -15.588
InChIKey:WWOQYJJUPNKWQK-UHFFFAOYSA-N
ID: 61982
SMILES:C(C)Cc1cc(O)c2c(c1)OC1(C)CC2C(=C(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -15.668
InChIKey:MNCLPSNXTHIMAY-UHFFFAOYSA-N
ID: 61983
SMILES:c1c(CCCCC)cc2c(c1O)C1C(C(C)(O)C2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.329
InChIKey:OGTYERSWJNGKFK-UHFFFAOYSA-N
ID: 61984
SMILES:CC(CC(c1c(O)c2c(c(C=O)c1O)OC(C)(C)C1CCC(C)=CC21)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -14.724
InChIKey:QUJLMZCMRANPAJ-UHFFFAOYSA-N
ID: 61985
SMILES:C(c1c2c(c(O)c(OC)c1)CC=C(C)C(CC=C(C)C)O2)C=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -13.099
InChIKey:YQODDGUDJQBQPP-UHFFFAOYSA-N
ID: 61986
SMILES:C(CCc1cc2c(c(O)c1)C1C(C(=C)C)CCC(C)(O2)C1O)CO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -12.85
InChIKey:ZNNVWJRMHULDKC-UHFFFAOYSA-N
ID: 61987
SMILES:c1c(O)c2cc(CCCCC)cc(O)c2c(O)c1C1C=C(C)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.528
CB1 binding score: -15.077
InChIKey:VZSPHGUWRHWOHZ-UHFFFAOYSA-N
ID: 61988
SMILES:C(Cc1cc(O)c2c(c1)OC(CCC=C(C)C)(C)C(O)C2)(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -15.047
InChIKey:OZQKQTMAGCZMCK-UHFFFAOYSA-N
ID: 61989
SMILES:C1=C(C)C2=C(c3c(cc(CCCCC)cc3O)OC2(C)C)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.409
CB1 binding score: -16.999
InChIKey:LCZSIMJXEXJPAQ-UHFFFAOYSA-N
ID: 61990
SMILES:C1(C)=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: 61991
SMILES:C(CCCCC)C1=C(O)C(=O)c2c(cc3c(c2)-c2c(OC)cc(C)cc2OCC3C)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.549
CB1 binding score: -13.35
InChIKey:OAGWKQOPOLFDOI-UHFFFAOYSA-N
ID: 61992
SMILES:C(CC(CCCC(C)=CCc1cc(O)c(C)cc1O)C)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -17.334
InChIKey:RUTPKBVACOSZDU-UHFFFAOYSA-N