ID: 123019
SMILES:C(C)CCCc1cc2c(c(OC)c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.651
InChIKey:WHHGTWRLWIUHHT-UHFFFAOYSA-N
ID: 123020
SMILES:C1(CCC(=O)C(C)C)(C)CCc2c(O)cc(CCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -16.678
InChIKey:LHLNRHMXFSIVAZ-UHFFFAOYSA-N
ID: 123021
SMILES:CC(=O)Oc1cc(CCCCC)cc2c1C1C(CCC(O)(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -17.252
InChIKey:CPRFHMGDHALOQP-UHFFFAOYSA-N
ID: 123022
SMILES:C1C(C)=CC2C(c3c(O)cc(CCC)cc3OC23C(=O)CC(C)(OC)C(O)C3O)C1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.497
CB1 binding score: -14.595
InChIKey:OWRWTKBTORDFJK-UHFFFAOYSA-N
ID: 123023
SMILES:Oc1cc(CCCCC)cc(OCC=C(CCC=C(C)CCC=C(C)C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -16.832
InChIKey:BNWJZHOKQJYRLP-UHFFFAOYSA-N
ID: 123024
SMILES:CC1(Oc2c(CCCCC)cc(O)cc2)CC(C)=CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -13.724
InChIKey:ICMCVCVNRXVHDH-UHFFFAOYSA-N
ID: 123025
SMILES:C(CC)c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.805
InChIKey:CDBDULHNWQRYSY-UHFFFAOYSA-N
ID: 123026
SMILES:Oc1c(O)c(CCCCC)cc2c1C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.889
InChIKey:UQZHCXRAKGTLRR-UHFFFAOYSA-N
ID: 123027
SMILES:C1C2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC(Cl)C(C)(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.956
CB1 binding score: -16.194
InChIKey:RHTYADDSJMHPPQ-UHFFFAOYSA-N
ID: 123028
SMILES:C1C(C(=C)C)CCC(C)C1=Cc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.502
InChIKey:QBMSPQPOWDWADD-UHFFFAOYSA-N
ID: 123029
SMILES:C(=C(C)CCC=C(C)C)Cc1c(O)cc(CCC)cc1OC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.424
InChIKey:YJQPPBHWUXZYBD-UHFFFAOYSA-N
ID: 123030
SMILES:C1C=C(C)CC(c2c(O)cc(CCC)cc2OC)C1C(C)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -16.281
InChIKey:KNTGSAQTTWRYBR-UHFFFAOYSA-N
ID: 123031
SMILES:C1C2C(C)(C)Oc3cc(CCCCC[N+](C)(C)C)c(C)cc3C2CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.601
CB1 binding score: -15.71
InChIKey:DDEDBAHLEOSILM-UHFFFAOYSA-N
ID: 123032
SMILES:Oc1cc(CCCCC)cc(O)c1C1(C)CCCC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.447
CB1 binding score: -17.453
InChIKey:NIVAQGHPRXHFPI-UHFFFAOYSA-N
ID: 123033
SMILES:Oc1cc(CCCCC)cc(O)c1C1C=C(C)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 123034
SMILES:C1(OC(Cc2cc3c(c(OC)c2)OCO3)c2c(COC)coc2C)C(O)(C)CCC1C(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.551
CB1 binding score: -14.726
InChIKey:IEDRXPOILBEDNF-UHFFFAOYSA-N
ID: 123035
SMILES:C1CCC(C)(C)C2c3c(cc(CCCCC)cc3O)OC2C1(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.966
InChIKey:IKWGRORPNYNBJD-UHFFFAOYSA-N
ID: 123036
SMILES:CC12c3c(OC)cc(CCCCC)cc3OC1(C)CCC2C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -13.06
InChIKey:QEGYWZNQLKUGCD-UHFFFAOYSA-N
ID: 123037
SMILES:C1C(=O)C(C)CCC12Oc1c(O)c(C(C)C(CC)=O)c(O)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.449
CB1 binding score: -16.727
InChIKey:IWZWUHASIXWAHT-UHFFFAOYSA-N
ID: 123038
SMILES:CC(c1c(O)c(CC=C(C)C)c(C2C(C(=C)C)CCC(C)=C2)cc1CCCC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.643
CB1 binding score: -16.611
InChIKey:BSNIYMYYISNKJS-UHFFFAOYSA-N
ID: 123039
SMILES:C(CN)Cc1c(O)c(C2C=C(C)CCC2C(C)=C)c(OC)cc1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 329.484
CB1 binding score: -17.596
InChIKey:IRBRVWJZJBAMIS-UHFFFAOYSA-N