ID: 39628
SMILES:C1C2C(C)=CCCC2(C)CC2c3c(O)cc(CCC)cc3OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -15.761
InChIKey:NHGYYXPLCNIDLD-UHFFFAOYSA-N
ID: 39629
SMILES:C(=CCCC(=CCc1c(O)c(CC=C(CCC=C(C)C)C)cc(O)c1)C(=C)C)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.626
CB1 binding score: -15.67
InChIKey:HNJVUBYUTXZKPA-UHFFFAOYSA-N
ID: 39630
SMILES:C1(C)(C)C2CC=C(C)CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 39631
SMILES:CC1=CC2C(CC1)C(C)(C)Oc1c2cc(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -20.067
InChIKey:OBJJEVJNCDBGOD-UHFFFAOYSA-N
ID: 39632
SMILES:O1c2cc(CCCCC)cc(O)c2C2CC(C)=CC(C)C12C(c1ccccc1)=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.523
CB1 binding score: -15.026
InChIKey:NEHNUYFLSNBYIF-UHFFFAOYSA-N
ID: 39633
SMILES:C(CC)CCc1c(C(=O)O)c(O)c(CC=C(C)C)c(O)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.375
CB1 binding score: -19.394
InChIKey:IQDBYPKRWVDTCI-UHFFFAOYSA-N
ID: 39634
SMILES:C(c1cc(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1)C(OC)C1(C)CCC(c2ccoc2)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.591
CB1 binding score: -15.111
InChIKey:VDGVOSTVQSYDAZ-UHFFFAOYSA-N
ID: 39635
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(CO)CC1)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -13.694
InChIKey:GLSKPBLDQZRYIO-UHFFFAOYSA-N
ID: 39636
SMILES:C(C)CCCCc1cc2c(c(C3C(C(C)C)CCC(C)=C3)c1O)C(=O)C(C)C(=O)C2(CC=C(C)C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.716
CB1 binding score: -11.94
InChIKey:AQWMGCMBBRSNJA-UHFFFAOYSA-N
ID: 39637
SMILES:CCCc1cc2c(cc1)C(=O)C(c1c(O)c(C(O)=O)c(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.536
CB1 binding score: -16.284
InChIKey:WQXHPIHJJJOQAH-UHFFFAOYSA-N
ID: 39638
SMILES:C(c1c(OC)cc(O)c2c1OC(C)(C)C1CC=C(C)CC12)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.068
InChIKey:XQPHHPMKKATDRS-UHFFFAOYSA-N
ID: 39639
SMILES:C12C(C)(C)Oc3c(c(O)cc(CC)c3)C1CC(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -18.253
InChIKey:YQZKSASIODXUPT-UHFFFAOYSA-N
ID: 39640
SMILES:C1(O)C(C)(CCC=C(C)C)Oc2cc(OC(=O)C)cc(CCCCC)c2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -12.178
InChIKey:AMPPUDSSFPOFFA-UHFFFAOYSA-N
ID: 39641
SMILES:C1C2C(C)(C)Oc3c(c(OC)cc(CCCCCCCCCCCCCCCCC)c3)C2C=C(C(OC)=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 540.829
CB1 binding score: -12.358
InChIKey:OWCZWQSOMFAONM-UHFFFAOYSA-N
ID: 39642
SMILES:C(CCCC)c1cc(O)c2c(c1C=O)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.611
InChIKey:QXUCLIISXIFDCN-UHFFFAOYSA-N
ID: 39643
SMILES:C1(C)=CC2c3c(cc(CCCCC)cc3OC(C)=O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -19.106
InChIKey:DEWSJDIJFWQLOA-UHFFFAOYSA-N
ID: 39644
SMILES:Oc1cc(CCCCC)cc(O)c1C1OC(C)(CCC=C(C)C)C2C1C(O)(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -13.913
InChIKey:SYAQTXGXLGIVPN-UHFFFAOYSA-N
ID: 39645
SMILES:C(CCC)c1c2c(ccc1C)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -14.95
InChIKey:FJKZWIYUWGFUPH-UHFFFAOYSA-N
ID: 39646
SMILES:Oc1cc(C)cc(O)c1C1C(C(C)CCC=C(C)C)C(O)CC(CO)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.335
InChIKey:AQKDIDGJBSOPBP-UHFFFAOYSA-N
ID: 39647
SMILES:C(Cc1cc(O)c(C2CC(C)CCC2C(C)=C)c(O)c1)=CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -13.228
InChIKey:NDODJOBTDBBRIZ-UHFFFAOYSA-N
ID: 39648
SMILES:C12=C(C(O)(C)c3c(cc(CCCCC)cc3O)OC1(C)C)C(=O)C([N+]([O-])=O)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 387.432
CB1 binding score: -14.796
InChIKey:CYBRGKGJUKILRV-UHFFFAOYSA-N