ID: 129970
SMILES:c1c(OCC=C(C)C)cc(CC(C)C)cc1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.475
CB1 binding score: -13.039
InChIKey:KJJPXCPDLCPEJG-UHFFFAOYSA-N
ID: 129971
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.233
InChIKey:LXSFNMQURHTPIT-UHFFFAOYSA-N
ID: 129972
SMILES:CC1(C)C2CCC(C)=CC2c2c(O)cc(C(CCCCC)C)c(O)c2C1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -15.843
InChIKey:YFPLCHPCCKCXIO-UHFFFAOYSA-N
ID: 129973
SMILES:C(=O)c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -18.162
InChIKey:YJJAQQDUFGCQBU-UHFFFAOYSA-N
ID: 129974
SMILES:CCCCCc1ccc(O)c(C2C=C(C)CCC2C(C)CCC=C(C)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -15.116
InChIKey:PKIBMQUTQZKQGF-UHFFFAOYSA-N
ID: 129975
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C(O)(C(O)C3(C)CCCC32C(OC)=O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.475
CB1 binding score: -15.103
InChIKey:TULXPTYMYSJDAE-UHFFFAOYSA-N
ID: 129976
SMILES:C1(C)(C)C2CCC(C)C=C2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.727
InChIKey:YLTWYAXWDLZZCU-UHFFFAOYSA-N
ID: 129977
SMILES:C(C(C)=CCCC(C)=CCc1cc(O)cc(CCc2cc(O)c(O)cc2)c1OC)CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.646
CB1 binding score: -13.692
InChIKey:QSTPGXKVJDETDC-UHFFFAOYSA-N
ID: 129978
SMILES:C12=CCC(C)CC1C(O)(C)CC1C2c2c(cc(CCCCC)cc2O)OC1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -14.217
InChIKey:FSBSBTZYBPNAJF-UHFFFAOYSA-N
ID: 129979
SMILES:c1(OC)c2c(c(Br)c(CCl)c1)OC(C)(CCCC(C)C)C=C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 387.745
CB1 binding score: -15.413
InChIKey:BOSQWVVUGAKHEP-UHFFFAOYSA-N
ID: 129980
SMILES:c1(C)cc(O)cc(C2C(C(=C)C)CCC(C)=C2)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -17.706
InChIKey:FBXSVXARSUKKDJ-UHFFFAOYSA-N
ID: 129981
SMILES:C12c3c(O)cc(O)cc3OC(C)(C)C3CCC(C)(O)CC13O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.358
CB1 binding score: -14.379
InChIKey:QYMRQYLRLPVSFT-UHFFFAOYSA-N
ID: 129982
SMILES:CC(C)=CCCC(C)=CCc1c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N
ID: 129983
SMILES:c1(CC2C(C(C)(C)O)CCC(C)=C2)c(O)cc(CCCCC)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.538
CB1 binding score: -15.058
InChIKey:MGYCELLRBFQIOT-UHFFFAOYSA-N
ID: 129984
SMILES:C(=C(C)C)CCC(C)=CC(=O)c1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(CCC=C(C)C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.674
CB1 binding score: -15.379
InChIKey:CTVCCHFKFLFOSA-UHFFFAOYSA-N
ID: 129985
SMILES:CC(C)C1=CCC2(C)Oc3c(c(O)ccc3C(CCCC)O)CC2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.568
InChIKey:JNJMHONUUXOYCN-UHFFFAOYSA-N
ID: 129986
SMILES:CC(CCC(CCC=C(C)C)C(=O)OC)=CCc1c(O)c(C)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.951
InChIKey:OHPITRIUXIKUDQ-UHFFFAOYSA-N
ID: 129987
SMILES:Oc1c(C2C(C(=C)C)CCC(C)=C2)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 129988
SMILES:C1CC2(C)c3c(O)c(OC(C)=O)cc(CCCCC)c3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -14.478
InChIKey:SKJLRHKOLCMOHU-UHFFFAOYSA-N
ID: 129989
SMILES:C1(C(C)(O)C)OC(c2c(O)cc(CCCCC)cc2O)CC1=C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -13.606
InChIKey:OMTFZCVUDWHFJD-UHFFFAOYSA-N
ID: 129990
SMILES:C(CCC)c1cc(O)c2c(c1)OC(C1(C)OC(C(O)(CCC=C(C)C)C)CC1)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -16.091
InChIKey:CWBKGBHEIAGZID-UHFFFAOYSA-N