ID: 60817
SMILES:C1(C(=C)C)C(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: 60818
SMILES:O(c1c2c(cc(CCCCC)c1)OC(C)(CCC=C(CCCC(CC(O)=O)C)C)C=C2)C(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.65
CB1 binding score: -14.082
InChIKey:XMXFISBDAFUNAN-UHFFFAOYSA-N
ID: 60819
SMILES:O1C2(CO)C(C)(CCC1(C)C(OC)=O)Oc1c(c(OC)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.519
CB1 binding score: -11.192
InChIKey:GYGZKHCYGAXPCC-UHFFFAOYSA-N
ID: 60820
SMILES:C1C(C)=CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 60821
SMILES:C12C(=CC(=C)CC1)c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -18.44
InChIKey:KJWARAZFZUTBKD-UHFFFAOYSA-N
ID: 60822
SMILES:CC1=C2C3C(CC1)C(C)(C)Oc1cc(C)c(cc12)C(=O)C3=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.366
CB1 binding score: -15.849
InChIKey:IROBTPKIUSCDDV-UHFFFAOYSA-N
ID: 60823
SMILES:C12C(c3c(cc(CCCCCOC)cc3OC)OC1(C)C=C)C1=C(C)C(=O)C(=O)C2C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.564
CB1 binding score: -14.965
InChIKey:KAZKENHMUUVOLD-UHFFFAOYSA-N
ID: 60824
SMILES:C1(O)(C)CCC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 60825
SMILES:c12c(cc(CCCCC)cc1O)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: 60826
SMILES:c1(Cc2cc(O)c(C(=O)O)c(C)c2)c(CCCCC)c2c(cc1O)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.629
CB1 binding score: -13.713
InChIKey:RJMZGUMLWHZFFP-UHFFFAOYSA-N
ID: 60827
SMILES:C(Oc1c(CC=C(C)CCC=C(C)C)cc2c(c1)OC(C)(C)C1C2CC(C)=CC1)(=O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.609
CB1 binding score: -13.39
InChIKey:JZXOJXSZKVFUSM-UHFFFAOYSA-N
ID: 60828
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C(C(C)(O)COC(=O)C2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -16.652
InChIKey:WTWGGFLAZBIMGW-UHFFFAOYSA-N
ID: 60829
SMILES:c12C(C)(C)CCCC1(C)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.783
InChIKey:KPTGTVLDBMVBEX-UHFFFAOYSA-N
ID: 60830
SMILES:c1(O)c(O)c(C(=O)CC(C)C)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -13.764
InChIKey:FUPKCLQESWDMHB-UHFFFAOYSA-N
ID: 60831
SMILES:C(Cc1cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -17.784
InChIKey:QPUHYZGLKQWEKI-UHFFFAOYSA-N
ID: 60832
SMILES:C1(=O)OC2C3(CO1)c1c(cc(CCCCC)cc1O)OC(C)(CC2)C3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.423
CB1 binding score: -13.181
InChIKey:UXDZPVJGPJBQKL-UHFFFAOYSA-N
ID: 60833
SMILES:C1Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 192.258
CB1 binding score: -17.99
InChIKey:CBNHBFQWUZBCDS-UHFFFAOYSA-N
ID: 60834
SMILES:C=CCCCc1cc(O)c(CC=C(C)C(=O)CC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.303
InChIKey:WYPIDUHNINXJPR-UHFFFAOYSA-N
ID: 60835
SMILES:C(C)CCCc1cc2c(c(O)c1)C1C(C(O)(C)CCC1C(=C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.142
InChIKey:RBEAVAMWZAJWOI-UHFFFAOYSA-N
ID: 60836
SMILES:C1(C)=CC(C)CC(C)(C)Oc2c(O)c(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -13.434
InChIKey:PZJKCXXFFTVGFL-UHFFFAOYSA-N
ID: 60837
SMILES:C(CN(C)C)(N1C=Cc2c(C(=O)O)c(CCCCC)c(C3C(C(C)=C)CCC(C)=C3)c(O)c2CC1CCCCC)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 564.811
CB1 binding score: -14.982
InChIKey:WMBUGJDJBYTPBN-UHFFFAOYSA-N