ID: 9031
SMILES:C(C)(=CCC1(O)OC(C(O)C(=CCc2c(OC)c(C)cc(OC)c2)C)CC=C1C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -15.395
InChIKey:MADMTWLRTMLCTI-UHFFFAOYSA-N
ID: 9032
SMILES:ClCCN(CCC)C(O)c1cc2c(cc1C)OC(C)(C)C1C2CC(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 393.999
CB1 binding score: -12.037
InChIKey:VXCPQJUIIBIUKI-UHFFFAOYSA-N
ID: 9033
SMILES:CC(C1C2C=C(C(=O)OC)CCC2c2c(cc(CCCCC)cc2O)O1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.161
InChIKey:CPUMYGXPJODLMT-UHFFFAOYSA-N
ID: 9034
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C(C1(C)C)CC=C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 9035
SMILES:C1C(C(C)=C)C(c2ccccc2OC)C=C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -18.382
InChIKey:PIWOIVDTYQHIGV-UHFFFAOYSA-N
ID: 9036
SMILES:C(C)CCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 9037
SMILES:CC(c1c(=O)cc(O)c2c(c1)OC(C)(C)C1C2CC(C(=O)OC)=CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.434
CB1 binding score: -15.544
InChIKey:ZQJYIFSDFFSPMA-UHFFFAOYSA-N
ID: 9038
SMILES:O(C1CC2C(C)(C)Oc3cc(CCCC)cc(O)c3C2C=C1C)C(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.9
InChIKey:XTBDGQPCFGCJFV-UHFFFAOYSA-N
ID: 9039
SMILES:C12(c3c(cc(CCC(CCOC)OC)cc3OC)O1)CC(CC=C(C)C)C(C)=CC1(O)C23C(=O)c2ccccc2OC(C)(C)C(O)C3O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 662.82
CB1 binding score: -13.708
InChIKey:YJHRTVPAKLDQRB-UHFFFAOYSA-N
ID: 9040
SMILES:c1c2c(c(CCCCC)cc1O)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.63
InChIKey:LAYHJCJKKWVWTP-UHFFFAOYSA-N
ID: 9041
SMILES:C(C)C(C)C(=O)c1c2c(c(O)c(C=O)c1O)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Phloroglucinols
Class: Cannabinoids;Phloroglucinol-terpene hybrids
MW: 372.461
CB1 binding score: -18.795
InChIKey:OTDNGRYIMUPGQU-UHFFFAOYSA-N
ID: 9042
SMILES:c12c(O)cc3c(c1OC(C)(C)C1CCC(C)=CC31)CC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -15.29
InChIKey:NNRLHPZDPZPKBI-UHFFFAOYSA-N
ID: 9043
SMILES:Oc1c(C(OS(=O)(O)=O)C(C)C)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.504
CB1 binding score: -14.755
InChIKey:MMHMFOILSWBOGR-UHFFFAOYSA-N
ID: 9044
SMILES:O=C(N(CCC)CC)c1cc2c(cc1O)OC(C)(C)c1ccc(C)cc1-2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 353.462
CB1 binding score: -16.502
InChIKey:YXEIZAVLWBHOTB-UHFFFAOYSA-N
ID: 9045
SMILES:C12C(C=C(C)CC1)c1c(cc(CCCC)o1)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -16.335
InChIKey:CFHKUEAUJXGKKE-UHFFFAOYSA-N
ID: 9046
SMILES:CC1=CC(c2c(O)cc(CCCCCN=C)cc2)C(C(COC(=O)CC(C)C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 425.613
CB1 binding score: -17.426
InChIKey:DIMCVEUKQNXXFJ-UHFFFAOYSA-N
ID: 9047
SMILES:CC1CC2C(C(=C)C(=O)O2)CC2c3c(cc(CCCCC)cc3O)OC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -15.815
InChIKey:IEKUUBQQRARHJL-UHFFFAOYSA-N
ID: 9048
SMILES:O=Cc1c(O)cc2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -17.621
InChIKey:ZAHOXGPXIYQXDR-UHFFFAOYSA-N
ID: 9049
SMILES:C=C(C)C1CCC2C(C)CCC3C12Oc1c3c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -10.575
InChIKey:BKHAKWOIBFQJIJ-UHFFFAOYSA-N
ID: 9050
SMILES:C1C2(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.228
InChIKey:XQYSGOVDVJLJAU-UHFFFAOYSA-N
ID: 9051
SMILES:C(CC)Cc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N