ID: 72808
SMILES:C(=C)(C1=CCC2(C)OC3=C(CC12)C(=O)C1C(C)(C)OC(C)(C)CC1C3=O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -14.537
InChIKey:OEHHHIOLWCHGEA-UHFFFAOYSA-N
ID: 72809
SMILES:C1C2(C1)C(C)(C)Oc1c2c(O)cc(C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 204.269
CB1 binding score: -16.054
InChIKey:RAMPJSPWEOBUEG-UHFFFAOYSA-N
ID: 72810
SMILES:C12C3C1(C)CC1c4c(O)cc(CCCCC)cc4OC4(C)C(C3)C2C14
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.491
CB1 binding score: -15.42
InChIKey:QROLEYYGUACZLD-UHFFFAOYSA-N
ID: 72811
SMILES:OC1C(=C)CCC2C(CC(=O)C)C(C)(C(=O)O2)Oc2c1c(O)cc(CCCCC)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.514
CB1 binding score: -15.134
InChIKey:UTOLIGYTQHWNDW-UHFFFAOYSA-N
ID: 72812
SMILES:C(OC(C(=CCc1cc(OC)cc(C)c1O)C)C1(C)CCCC1(C)C)CCCCC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.646
CB1 binding score: -15.414
InChIKey:SGUKADNXHZYHGV-UHFFFAOYSA-N
ID: 72813
SMILES:Oc1c(CC2C(=C)CCC3C(C)(C)OC(CCC)C32C)cc(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.502
InChIKey:AWEBPRMEHKVIIK-UHFFFAOYSA-N
ID: 72814
SMILES:C1(C)(C)CCCC2(C)c4c(O)cc(C)cc4OC(C)(C)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -16.093
InChIKey:MGPPACJBMUXEFT-UHFFFAOYSA-N
ID: 72815
SMILES:Oc1cc2c(cc1CC)OC(C)(C)C1CCC(=C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -13.687
InChIKey:AGSWSTOOAGOWIZ-UHFFFAOYSA-N
ID: 72816
SMILES:C(CC)CCCc1cc2c(c(O)c1)CCC(C)(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.393
CB1 binding score: -17.334
InChIKey:ZMGFRFFKKHYIJS-UHFFFAOYSA-N
ID: 72817
SMILES:C(C1(C)Oc2c(c(O)cc(CCCCC)c2)C(O)C1O)CC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 308.418
CB1 binding score: -14.317
InChIKey:PBCJDTUQBZKBSW-UHFFFAOYSA-N
ID: 72818
SMILES:OC(CCCC)c1cc(O)c(CC=C(C)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -15.88
InChIKey:NNVDZTBZPJDBGL-UHFFFAOYSA-N
ID: 72819
SMILES:c1(OC(=O)C)cc(CCCCC)cc2oc3c(O)c(CC=C(CCC=C(C)C)C)c(O)c(C(C)C)cc3cc12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 532.721
CB1 binding score: -13.312
InChIKey:IBTAQZUDWIKJPT-UHFFFAOYSA-N
ID: 72820
SMILES:c1cccc(O)c1C1C(C(CCC=C(C)C)C)C(O)CC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.619
InChIKey:VTDJMCUSJUXEOD-UHFFFAOYSA-N
ID: 72821
SMILES:C(=C1C(CC(O)=O)C(C(C)=C)C(c2c(O)cc(CCCCCO)cc2O)CC(C)=C1)(O)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.633
CB1 binding score: -14.944
InChIKey:LAGOYQGLCNMUDQ-UHFFFAOYSA-N
ID: 72822
SMILES:C(c1c(CCCCC)cc2c(c1OC)CC(O)C(C)(CCC=C(C)C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.565
CB1 binding score: -14.744
InChIKey:UXYWFKRNQMCPBF-UHFFFAOYSA-N
ID: 72823
SMILES:C1(C)=CC2(C(C)(C)Oc3c2c(O)cc(CCC)c3)CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -14.577
InChIKey:XEIZHCFWXJJKNQ-UHFFFAOYSA-N
ID: 72824
SMILES:C(C(C)=CCc1c(O)cc(CC)cc1O)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -18.374
InChIKey:FYEVCSFOWVVFOK-UHFFFAOYSA-N
ID: 72825
SMILES:CCCCCCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -20.649
InChIKey:ZHYPKENABBMAAN-UHFFFAOYSA-N
ID: 72826
SMILES:C1(=C(C)C)C2C3C(C)(CCC2(C)CC1)Oc1c3c(O)cc(CCCSC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.601
CB1 binding score: -14.381
InChIKey:PNRXNOMOGOFCLC-UHFFFAOYSA-N
ID: 72827
SMILES:C(CCCC=C)Cc1cc2c(c(O)c1)C1C=C(COC(C)=O)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -15.636
InChIKey:NYMIRYKBTFWGDK-UHFFFAOYSA-N
ID: 72828
SMILES:Oc1c(CC=C(C)CCC=C(C)C)cc(CCCC)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 286.459
CB1 binding score: -18.208
InChIKey:PSMHNXSQELAMNN-UHFFFAOYSA-N