ID: 49813
SMILES:CC(=CC(=O)OCc1c(CC2C(C)(OC)OC(=O)C2)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 498.616
CB1 binding score: -14.535
InChIKey:QYNYANIEZMQIQU-UHFFFAOYSA-N
ID: 49814
SMILES:OCc1cc(O)c2c(c1C(=O)C=CC)OC(C)(C)C1C2C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.434
CB1 binding score: -14.839
InChIKey:ZEZWBZSNIFYSRS-UHFFFAOYSA-N
ID: 49815
SMILES:C1CC(C)C2=C(CC1C(C)=C)C(C)(C)Oc1cc(CCc3ccccc3)cc(O)c12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.578
CB1 binding score: -17.199
InChIKey:CMILKIAGWWEYQM-UHFFFAOYSA-N
ID: 49816
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: 49817
SMILES:CC(C)=CCCC1(C)Oc2cc(O)cc(CCCCC)c2C(=O)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.361
InChIKey:NRDWIYFOWUUQDH-UHFFFAOYSA-N
ID: 49818
SMILES:Oc1c(C(C(CCC(C)C)=O)C)c(O)c2c(c1)OC(C)(CC=CC(O)(C)C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.546
CB1 binding score: -15.104
InChIKey:GICNNCCUMHMOPD-UHFFFAOYSA-N
ID: 49819
SMILES:O(O)C12CC(C(C)=C)C(O)C=C(CCC(C(=C)C)C=C1C)Oc1c(cc(CCCCC)cc1O)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.633
CB1 binding score: -16.294
InChIKey:YOPZNFBOXZEQGR-UHFFFAOYSA-N
ID: 49820
SMILES:C(=O)C1C(O)C2c3c(cc(CCCCC)cc3O)OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -15.762
InChIKey:WLRMMFGTOFLRID-UHFFFAOYSA-N
ID: 49821
SMILES:C(C1C(O)C2C(C)(Oc3c(ccc(CCCCCO)c3)C2)CC1)(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.63
CB1 binding score: -15.467
InChIKey:YXTZWBVGUXRTIL-UHFFFAOYSA-N
ID: 49822
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C=CC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -20.121
InChIKey:PJBASZVNRDGSFZ-UHFFFAOYSA-N
ID: 49823
SMILES:c1(OC(C)=O)cc(CCCCC)cc2c1-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.474
CB1 binding score: -17.994
InChIKey:LCXOAMRAVSWHBP-UHFFFAOYSA-N
ID: 49824
SMILES:C(c1c2c(c(O)c(C)c1)OC(C)(C)C1CCC(C)=CC21)(CC)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -14.112
InChIKey:OCIRSSOZXWGZAH-UHFFFAOYSA-N
ID: 49825
SMILES:C12(Oc3c(c(O)cc(CCCC)c3)C1)OC(C=CC(=O)C)(C)CCC1C(C)(CC2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -15.486
InChIKey:VCYOOGXCGYTZBF-UHFFFAOYSA-N
ID: 49826
SMILES:C(CCCc1c(C(=O)O)c2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -14.975
InChIKey:FWSINDSAURJWDR-UHFFFAOYSA-N
ID: 49827
SMILES:c1(CC2C(C)(C)OC(=O)C2)c(CCCCC)cc(O)c2c1OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.624
CB1 binding score: -15.929
InChIKey:PGXLEGMKBRWOQB-UHFFFAOYSA-N
ID: 49828
SMILES:C(=CCc1c(O)cc(CC(O)C)c(O)c1)(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -18.306
InChIKey:QJRQZQBJSJPOFD-UHFFFAOYSA-N
ID: 49829
SMILES:C1=C(C(O)C)C(=O)C2=C(C3C(C(C)(C)O2)CCC(C)=C3)C1(O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -15.808
InChIKey:IJTRRZRROKOWSA-UHFFFAOYSA-N
ID: 49830
SMILES:C(C)CCCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 49831
SMILES:C1(C)=CC2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 49832
SMILES:c1(O)cc(CCCCC)cc2c1C1C(C(C)(C)O2)CCC(C)(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 49833
SMILES:C(Cc1cc2c(c(O)c1)OC(C)(C)C1C2C=C(C(=O)OC)CC1)(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -19.276
InChIKey:IPHXXRZQPNNFBQ-UHFFFAOYSA-N