ID: 52816
SMILES:O=C1C=C(C)CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -18.452
InChIKey:LPQMFAVBXYKLOA-UHFFFAOYSA-N
ID: 52817
SMILES:CC1(C)CC(c2c(O)cc(CCCCC)c(CC=C)c2)C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -15.703
InChIKey:KXLVMRUHRYDDAP-UHFFFAOYSA-N
ID: 52818
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1CC=C(C)C(=O)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.892
InChIKey:WBFVHFCVGUDTNV-UHFFFAOYSA-N
ID: 52819
SMILES:CC(=CCc1c(OC2C(O)C(O)C(O)C(C)O2)c(CCCCC)cc(O)c1)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.627
CB1 binding score: -16.57
InChIKey:DUAFPNXAFDCUQF-UHFFFAOYSA-N
ID: 52820
SMILES:C(=C)(C)C1C(c2c(O)cc(CCCCC)cc2O)CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.998
InChIKey:KAQRYDKQGRYUSV-UHFFFAOYSA-N
ID: 52821
SMILES:C1(C(C)(C)O)OC2(C)C(O)(CC(C)=C)Oc3cc(CCCCC)cc(O)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.547
CB1 binding score: -13.592
InChIKey:OWELEICDDBCXDX-UHFFFAOYSA-N
ID: 52822
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C(C(C)=C)CCC3(OC3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.801
InChIKey:KYRGAGKZJJLFAR-UHFFFAOYSA-N
ID: 52823
SMILES:CC1(C)C2C(C)=CC3(c4cc(O)c(C(C)(C)CCCCC)cc4O3)OC2(C)CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -16.803
InChIKey:ZFJRYWZMXTYOPC-UHFFFAOYSA-N
ID: 52824
SMILES:C(C)(=CCc1c(O)c(CC=C(C)C)c(CCCCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.539
CB1 binding score: -16.815
InChIKey:DMXYVNQRMRHMQS-UHFFFAOYSA-N
ID: 52825
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CC=C(COC(=O)C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -17.833
InChIKey:KUXDVXVRZZGDMG-UHFFFAOYSA-N
ID: 52826
SMILES:C(C)(C1C(c2c(O)cc(CC)cc2O)C=C(C)CC1)CCC=C(CO)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -16.645
InChIKey:QEZIDERRHDEHOE-UHFFFAOYSA-N
ID: 52827
SMILES:CC1=CC2C(O)(C2(C)C)CC12Oc1c(c(O)cc(CCCCC)c1)C2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -14.412
InChIKey:PHHXMKCILGAGBA-UHFFFAOYSA-N
ID: 52828
SMILES:C1(O)(C)C2C(O)CC(C)CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -17.218
InChIKey:HJVXFWYZPNHZJU-UHFFFAOYSA-N
ID: 52829
SMILES:C1=C(C)C(OC)CC2C(C)(C)Oc3cc(C)c(C(=O)O)c(C=C)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -12.197
InChIKey:JLIYAIMMYHUCEV-UHFFFAOYSA-N
ID: 52830
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2CC(C(=C)C(=O)OC)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -16.261
InChIKey:SVUNOKWDTDBICB-UHFFFAOYSA-N
ID: 52831
SMILES:C(CCc1cc(O)c2c(c1)C13C(=O)OC(C2O3)C1)(C)(C=CC=C(C)C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.418
CB1 binding score: -14.03
InChIKey:SVAZYLLZSNNJOF-UHFFFAOYSA-N
ID: 52832
SMILES:C(CCCC)c1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 52833
SMILES:C1C(C(C)C)C(c2cc(CC=C(C)CCC=C(C)C)cc(O)c2O)CC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -15.325
InChIKey:GCJUERPUJNVXOL-UHFFFAOYSA-N
ID: 52834
SMILES:C1C(C)(C)C2C(C)(CC1)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: 52835
SMILES:CC1(C)Oc2c(O)c(CCCCC)cc(OC)c2C2C1CC=C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.034
InChIKey:ZEOZUWMUTMYKGU-UHFFFAOYSA-N
ID: 52836
SMILES:C(Cc1c(O)c2c(cc1CCCCC)OC(C)(C)C1C2C=C(C)CC1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -16.206
InChIKey:LTBZRKCKKICVIC-UHFFFAOYSA-N