ID: 25873
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 25874
SMILES:COc1c(C(OC)=O)c(CC(O)C)cc2c1C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -16.065
InChIKey:BDEVHWKHEYUING-UHFFFAOYSA-N
ID: 25875
SMILES:Oc1ccc(O)c2c1-c1c3c(cc(CCCCC)c1)OC(C)(C)C1C3C=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.55
CB1 binding score: -15.896
InChIKey:SYFGMYASLVTUQC-UHFFFAOYSA-N
ID: 25876
SMILES:C(c1c(O)cc(OC)c2c1OC(C)(C)C1=C2CC(C)=CC1)C1=C(C)CCCC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.582
CB1 binding score: -16.027
InChIKey:WSMKOODEVAEFTR-UHFFFAOYSA-N
ID: 25877
SMILES:C1(CO)(C)Oc2cc(CCCCC)cc(O)c2C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.583
InChIKey:AFSGVVWOXYAPKB-UHFFFAOYSA-N
ID: 25878
SMILES:CCC(O)Cc1cc2c(c(O)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.624
InChIKey:ZKGBPYCKTOCPLS-UHFFFAOYSA-N
ID: 25879
SMILES:CC(C(O)CC=C(C)C)=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -16.446
InChIKey:OUOQXFQTVUXZJA-UHFFFAOYSA-N
ID: 25880
SMILES:C(CCCCc1cc(OC)c(C2C(C(C)=C)CC(Cl)C(C)(O)C2O)c(O)c1)C(=O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.964
CB1 binding score: -13.908
InChIKey:WGEUQYXQGCXXCH-UHFFFAOYSA-N
ID: 25881
SMILES:C(CCCC)Cc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.929
InChIKey:VYHNYNASWRTVGZ-UHFFFAOYSA-N
ID: 25882
SMILES:CC(CO)=CC(c1c(O)c2c(c(C(CCC)=O)c1O)OC(C)(C)C1C2C=C(C)CC1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.525
CB1 binding score: -13.39
InChIKey:AXOZSAXCZFPJFT-UHFFFAOYSA-N
ID: 25883
SMILES:CC(CCCC1(C)CC2(c3c(O)cc(C)cc3C(C)CC2C)O1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -14.594
InChIKey:WUKKENARLKIXDW-UHFFFAOYSA-N
ID: 25884
SMILES:CC1(C)Cc2cc(C(OC)=O)c(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -15.292
InChIKey:KLSWEUGNSZKHAX-UHFFFAOYSA-N
ID: 25885
SMILES:C(CCCC)c1cc2c(cc1O)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.716
InChIKey:MMMBBXWSLJXQAV-UHFFFAOYSA-N
ID: 25886
SMILES:OCC1=CC2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 25887
SMILES:CC(C)C(=C)C(Cc1c2c(O)c(CC(C(C)(C)O)O)c(CC=C(CCC=C(C)C)C)c1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 594.877
CB1 binding score: -16.205
InChIKey:FTQMYPRJXXTVOR-UHFFFAOYSA-N
ID: 25888
SMILES:COc1c(OC2C(O)C(O)C(O)C(CO)O2)c(CC2(CC=C(CCC=C(C)C)C)Oc3cc(O)cc(C)c3C2)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 600.705
CB1 binding score: -14.547
InChIKey:CMRAFWWEMNJINC-UHFFFAOYSA-N
ID: 25889
SMILES:OCCCC1=CC2OC3C(C(=O)O)=CC4C(C(C)=C)CCC13C24c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.628
CB1 binding score: -15.137
InChIKey:JKOMCWYHYAXICA-UHFFFAOYSA-N
ID: 25890
SMILES:O1C(C)(C)C2CCC(C)=CC2c2c(OC)cc3c(c21)C(C)(C)C(=O)OC31OC(C)(CCC=C(C)C)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 506.683
CB1 binding score: -15.57
InChIKey:YCMXNZVRKREHSP-UHFFFAOYSA-N
ID: 25891
SMILES:C(CCCCCN)c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C(=O)O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 375.509
CB1 binding score: -15.334
InChIKey:KGVRGYOQMIBKBL-UHFFFAOYSA-N
ID: 25892
SMILES:c1(O)c2c(cc(CCCCC)c1O)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.71
InChIKey:QQTIDTRRWYIZRE-UHFFFAOYSA-N
ID: 25893
SMILES:c1c(O)cc(C)c2c1OC(C(O)C=CC(C)(O)C)(C)C1C2C(O)(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -14.232
InChIKey:XPJWRZAWZOEGLV-UHFFFAOYSA-N