ID: 27805
SMILES:O1c2c3c(cc(CCCCC)c2)OC(C)(C)C2CCC(C)C3C=C2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -13.864
InChIKey:OYTSPCAMUFAJBO-UHFFFAOYSA-N
ID: 27806
SMILES:Oc1c2c(cc(C#Cc3ccc(C)cc3)c1)OC(CO)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.48
CB1 binding score: -17.251
InChIKey:MQJMAKADLLSBKQ-UHFFFAOYSA-N
ID: 27807
SMILES:Oc1cc(CC=C(C)C)c(O)c(CC=C(CCC=C(C)C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.748
InChIKey:VRXKPPYOGGSRFK-UHFFFAOYSA-N
ID: 27808
SMILES:C1c2c(O)cc(CCCCC)cc2OC(CCC=C(C)C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.791
InChIKey:ORKZJYDOERTGKY-UHFFFAOYSA-N
ID: 27809
SMILES:c1(CCCCCC)cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(CO)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -18.264
InChIKey:JSQZQNWIVUSPJH-UHFFFAOYSA-N
ID: 27810
SMILES:C(CC1C(=C)CCCC1(C)CO)C(C)(c1c(O)c(C)cc(OC)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -14.802
InChIKey:BYFYBFVYEAFJAW-UHFFFAOYSA-N
ID: 27811
SMILES:Oc1c2c(cc(C=CC=O)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.382
CB1 binding score: -16.952
InChIKey:BLIYMYHCLBATIA-UHFFFAOYSA-N
ID: 27812
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C(C=C(C(O)=O)C)C1(O)C2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.46
CB1 binding score: -14.052
InChIKey:FNNWVLWWUIUGOP-UHFFFAOYSA-N
ID: 27813
SMILES:c1(COCCCC)cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.502
InChIKey:QTARROJNPSGQHM-UHFFFAOYSA-N
ID: 27814
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CC(O)C(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.534
InChIKey:INKUWBOHCFHXTJ-UHFFFAOYSA-N
ID: 27815
SMILES:Cc1cc(O)c(O)c2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -16.326
InChIKey:TWSMWNXWNZRZTM-UHFFFAOYSA-N
ID: 27816
SMILES:C(=Cc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC12)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -16.669
InChIKey:GQOLGRCAYUBXIB-UHFFFAOYSA-N
ID: 27817
SMILES:c1c(CCC)cc(O)c2c1OC1(C)C(CCC(C)=CCC(C(C)=C)C(O)C1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -13.845
InChIKey:VCBHTXJJBYYBNZ-UHFFFAOYSA-N
ID: 27818
SMILES:c12c(c(O)cc(OC)c1)C1C(CCC)C(C)=CCC1C(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -14.605
InChIKey:IWIWMXZIWAOVFJ-UHFFFAOYSA-N
ID: 27819
SMILES:CC(=C)C1CC=C(C)CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.129
InChIKey:ZTGXAWYVTLUPDT-UHFFFAOYSA-N
ID: 27820
SMILES:C(CC)Cc1cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 27821
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1(O2)C=CC(C)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.363
InChIKey:RQWRJEBJAGLVAP-UHFFFAOYSA-N
ID: 27822
SMILES:C12(C)Oc3c(c(O)cc(CCC)c3)C(OC(=O)C)C1C(C)(CCCC(CCC=C(C)C)C)C(OC)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 512.731
CB1 binding score: -14.981
InChIKey:ARDCJNPQQPVDFG-UHFFFAOYSA-N
ID: 27823
SMILES:C(O)C1(C=CC=C(C)C)Oc2c(c(O)cc(CCCCC)c2)C(O)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -15.485
InChIKey:XNWNFHWLPYFRJW-UHFFFAOYSA-N
ID: 27824
SMILES:C1(=O)C(C)=CC2c3c(O)cc(CCCCCC)cc3OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.058
InChIKey:UXOBYFHCQYPOAT-UHFFFAOYSA-N
ID: 27825
SMILES:C1=CC(C)(C)CC2C(C)(C(=O)C=C(C)C13Oc1c(c(O)cc(CCCCC)c1)C3)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.582
CB1 binding score: -20.031
InChIKey:YZOLNVJVVRMYOR-UHFFFAOYSA-N