ID: 20728
SMILES:OC1CC(C(=C)C)C(c2cc(CCN(C)C)ccc2OC)C=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 329.484
CB1 binding score: -17.933
InChIKey:DOIPOJKBLDXMNY-UHFFFAOYSA-N
ID: 20729
SMILES:C12C(C)(C)CCCC1(C)Oc1c(c(OC(=O)C)cc(CCCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -15.055
InChIKey:LDRFBSMWUNIXRJ-UHFFFAOYSA-N
ID: 20730
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 20731
SMILES:c1(CC2C(C(=C)C)CCC3(C)C(O)C(O)CC(C)=C32)c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -14.886
InChIKey:YSFALYMCMXTTEN-UHFFFAOYSA-N
ID: 20732
SMILES:c1(O)c2c(cc(CCCCC)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: 20733
SMILES:C(COc1cc(C)c(C(OC)=O)c(O)c1C1C(C(C)C)CCC(C)=C1)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -13.731
InChIKey:ADPKGJGTHOTUAH-UHFFFAOYSA-N
ID: 20734
SMILES:C1C(O)C(C(=C)C)C(c2c(O)cc(CCCCCO)cc2OC)C(O)C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.509
CB1 binding score: Not available
InChIKey:GOUJAAZULWODFH-UHFFFAOYSA-N
ID: 20735
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 20736
SMILES:CC1(C)C2CC1CC=C2CCCC1(C)COc2c(c(O)cc(CCCCC)c2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -12.841
InChIKey:WOWXIEZRAPAWTC-UHFFFAOYSA-N
ID: 20737
SMILES:C1C=C(C)CC2C(C(C)(C)Oc3cc(CCCCCCCC)cc(O)c32)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -14.208
InChIKey:HSXCFZIGSPAUAL-UHFFFAOYSA-N
ID: 20738
SMILES:C1(c2c(O)cc(CCCCCO)cc2O)C=C(C)CC(C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -14.433
InChIKey:NSSNJPGQNFUWCZ-UHFFFAOYSA-N
ID: 20739
SMILES:C(C1=CC(CCC=C(C)C)(C)Oc2c1cc(O)cc2C(O)C)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -15.369
InChIKey:YRRUMNYODSXQBR-UHFFFAOYSA-N
ID: 20740
SMILES:C12C(C)(C3C(C=C1C)C(C)(C)CCC3)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -14.581
InChIKey:HXCMMMGELXLKRX-UHFFFAOYSA-N
ID: 20741
SMILES:C1(CCC=C(C)C)(C)Oc2c(c(O)cc(CCCCC)c2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.791
InChIKey:ORKZJYDOERTGKY-UHFFFAOYSA-N
ID: 20742
SMILES:CC12Oc3c(c(O)cc(CCCCC)c3)C3C1C(C(C)(O)CC3)CCC2(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -16.745
InChIKey:JCXIWIAEVATGAO-UHFFFAOYSA-N
ID: 20743
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 20744
SMILES:c12c(c(O)cc(CCCCC)c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 20745
SMILES:C(c1c(OC)c(O)c2c(c1)OC(C)(C)C1CCC(C(=O)O)=CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.396
CB1 binding score: -12.792
InChIKey:JJIVRCHWVOGNKL-UHFFFAOYSA-N
ID: 20746
SMILES:OC1CC(O)C(=C)CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.267
InChIKey:ZHEZOYLWYXGKBC-UHFFFAOYSA-N
ID: 20747
SMILES:C=C(C)C1C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 20748
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C=C(C(=O)OC)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.943
InChIKey:CCMWHLPOQSRJEP-UHFFFAOYSA-N