ID: 59725
SMILES:C(C)(c1cc(O)c2c3c1OC(C)(C)C1CCC(C)(CC12)O3)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -16.254
InChIKey:USZPTFBIWOFWKQ-UHFFFAOYSA-N
ID: 59726
SMILES:C1c2c(cc(CCCCC)cc2O)OC2(C(C)CCCC2(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -15.992
InChIKey:RGEXUTUHVOSMOA-UHFFFAOYSA-N
ID: 59727
SMILES:C(c1c2c(c(C)cc1O)C=CC(C)(CCC=C(C)C)O2)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -16.693
InChIKey:XRQVACQURBKQBR-UHFFFAOYSA-N
ID: 59728
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(CO)CC1)C=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -12.543
InChIKey:UGZFRKVWUZZMGP-UHFFFAOYSA-N
ID: 59729
SMILES:c1(O)c2c(cc(C(CCC)O)c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.303
InChIKey:JDQJZJYSRXMMOP-UHFFFAOYSA-N
ID: 59730
SMILES:C(c1cc(O)c2c(c1)OC1(C)OCC(C)C1C2)CC(C(C)C)C(C=C(C)C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -16.275
InChIKey:XXRNVXDKCGVCNB-UHFFFAOYSA-N
ID: 59731
SMILES:C12OC1C1(c3c(cc(CCCCC)cc3O)O2)CCC(C)C1=C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -14.668
InChIKey:QPJZMOBCXQLWCX-UHFFFAOYSA-N
ID: 59732
SMILES:c12c(cc(CCCCC)cc1O)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: 59733
SMILES:c1c(C)cc2c(c1OC)-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 268.356
CB1 binding score: -17.579
InChIKey:UEXVDOATPCCQRD-UHFFFAOYSA-N
ID: 59734
SMILES:C1C(O)(C)C2C3C1C(C)(C)Oc1cc(CCCCC)cc(c13)CC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -15.389
InChIKey:RJQUZHQWCKCOHF-UHFFFAOYSA-N
ID: 59735
SMILES:C1C(C)=CCC(C(C)(OC2C(O)C(O)C(O)CO2)C)C12Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 476.61
CB1 binding score: -14.254
InChIKey:NBJMSGHHXCPTTH-UHFFFAOYSA-N
ID: 59736
SMILES:O=C(OCC12c3c(O)cc(C)cc3OC(C)(C)C1CC2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.359
CB1 binding score: -15.334
InChIKey:BVKUFJFQKXWGBB-UHFFFAOYSA-N
ID: 59737
SMILES:c1(CCCCC)cc2c(c(OC)c1)C=CC(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -18.771
InChIKey:NUDQDNWIMDAJAE-UHFFFAOYSA-N
ID: 59738
SMILES:C1(C)=CC2C(C(C)(C)Oc3c2c(OC)cc(CCc2ccccc2)c3)OC1C(=C)CO
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.549
CB1 binding score: -15.103
InChIKey:QKLZQSQFBDIEPX-UHFFFAOYSA-N
ID: 59739
SMILES:C1C=C(C)CC(c2c(O)cc(CCCC)cc2O)C1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -17.738
InChIKey:GGQDIFOIULQGMW-UHFFFAOYSA-N
ID: 59740
SMILES:C(OC1CC2(C)Oc3c(c(OC)cc(CCCCC)c3)C3OC(C(O)(C)C2O1)C3)(C)=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.529
CB1 binding score: -14.767
InChIKey:YVJXBPUYXKILAL-UHFFFAOYSA-N
ID: 59741
SMILES:c1(CCCCC)cc2c(c(O)c1C(=O)CCc1ccc(O)cc1)OC(C)(C)C1CCC(C)(O2)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.645
CB1 binding score: -13.637
InChIKey:CSHCXMNOZHUTLT-UHFFFAOYSA-N
ID: 59742
SMILES:C(C1C(C)(C)Oc2c1c(OC)cc(CCc1ccccc1)c2)CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.529
CB1 binding score: -14.298
InChIKey:GMCXOQIUYJJJFU-UHFFFAOYSA-N
ID: 59743
SMILES:C(=O)(O)c1cc(OC)c2c(c1)OC(C)(C)C1CCC(CO)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.369
CB1 binding score: -12.131
InChIKey:SBCKYRMUWJDWRL-UHFFFAOYSA-N
ID: 59744
SMILES:C(CC(C)C)C(c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -18.872
InChIKey:QYPCCIVUJGOZMM-UHFFFAOYSA-N
ID: 59745
SMILES:C1C(C)CC2C(C(C)(C)Oc3c2c(O)cc(OC)c3C(O)C)CCC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -12.648
InChIKey:RWHBVJDUCFGFKR-UHFFFAOYSA-N