ID: 33874
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 33875
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.487
CB1 binding score: -19.108
InChIKey:KCGRQTUOQYSEJY-UHFFFAOYSA-N
ID: 33876
SMILES:C(CCCCCc1cc2c(c(O)c1)C1C=C(CO)CCC1C(C)(C)O2)CC(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -16.015
InChIKey:SMKWMTZLJDHDKM-UHFFFAOYSA-N
ID: 33877
SMILES:CC1c2cc(O)c(C)cc2OC(CCC=C(CCC=C(C)C)C)(C)C=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -16.655
InChIKey:RBLYWNWVCWGBAX-UHFFFAOYSA-N
ID: 33878
SMILES:C(=C(C)C)CCC1(C)C(O)Cc2c(C(C(CC)C)=O)c3c(cc21)OC(C)(C)C1C3C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.69
CB1 binding score: -16.39
InChIKey:GSABSJWXNFRVCB-UHFFFAOYSA-N
ID: 33879
SMILES:O1C(CC=C(C)C)C(=C)CCC=C(C)Cc2c1cc(O)cc2C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -12.626
InChIKey:WZTRLXVDDFMHSY-UHFFFAOYSA-N
ID: 33880
SMILES:C1(C)c2c(cc(C)cc2)-c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.41
CB1 binding score: -16.502
InChIKey:VHXMOHNSKFLXCB-UHFFFAOYSA-N
ID: 33881
SMILES:C1(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 33882
SMILES:C12(OC)C(c3c(cc(CCCCC)cc3OC)OC1(C)C)CC(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.345
InChIKey:CFSKWDCJDVHGCD-UHFFFAOYSA-N
ID: 33883
SMILES:CC1(C)Oc2cc(CCCCC)cc3c2C(=O)C(C(C)=C)(OO)C(O)(O3)CC(C)=CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.568
CB1 binding score: -13.244
InChIKey:WJQMZPSYNRSPLQ-UHFFFAOYSA-N
ID: 33884
SMILES:C1CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -16.943
InChIKey:TUXYVWWGZQJUFK-UHFFFAOYSA-N
ID: 33885
SMILES:C(CC=C(C)C)C(C)=CCCC(=CCc1c(O)cc(CCc2ccc(O)cc2)cc1O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.62
CB1 binding score: -19.427
InChIKey:VVBVATXKSUVSTB-UHFFFAOYSA-N
ID: 33886
SMILES:C(=O)(OCC1(C)C2C=CC(=O)C(O)C2c2c(cc(CCCCC)cc2O)O1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.46
CB1 binding score: -14.013
InChIKey:VVWUMLABWVUOFW-UHFFFAOYSA-N
ID: 33887
SMILES:CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -18.957
InChIKey:JJBMVXFZSLTKCL-UHFFFAOYSA-N
ID: 33888
SMILES:C1C(C)(CCc2c(C)cc(O)cc2C)OC(C)(CCC(C(=C)C)O)C(O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.537
CB1 binding score: -16.581
InChIKey:JGXDRAHRYXPKAX-UHFFFAOYSA-N
ID: 33889
SMILES:C1C2C(C(C)(Oc3cc(CCCCC)cc(O)c3)C1)C(O)CC(C)C2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -12.503
InChIKey:MQZSZKMQSVGHKH-UHFFFAOYSA-N
ID: 33890
SMILES:O1c2cc(CCCCC)cc(O)c2C2C=C(C)CCC2C(C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.813
InChIKey:YJVCZGPCBNNEJU-UHFFFAOYSA-N
ID: 33891
SMILES:c12c(c(CCCCC)c(C(O)=O)c(O)c1)OC1(C)CCC(C(C)(C)OC(C)=O)CC1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.557
CB1 binding score: -15.194
InChIKey:UYOGBCJWDWOZJR-UHFFFAOYSA-N
ID: 33892
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(O)C(C)(O2)CC2C(C1O)C(O)(C)CCC2C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.628
CB1 binding score: -14.868
InChIKey:YQGCCLBKWKCGPX-UHFFFAOYSA-N
ID: 33893
SMILES:C1(C)=CC(c2c(O)cccc2C)C(C(=C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -18.764
InChIKey:VCTOYXGKNMVKJN-UHFFFAOYSA-N
ID: 33894
SMILES:C1C(C(C)=C)C(c2c(O)cc(C)cc2)C=C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -19.801
InChIKey:MISWBPJELUDMFI-UHFFFAOYSA-N