ID: 80746
SMILES:C1=C(C)CCC(C(C)=C)C1c1c(O)cc(CCCCC)cc1Cl
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.915
CB1 binding score: -16.015
InChIKey:KHBOCQPMWBSXOR-UHFFFAOYSA-N
ID: 80747
SMILES:O(C(=O)CCCCC)COCc1cc2c(cc1CCCCC)C1C(CC2)C(C)(C)OC(=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.639
CB1 binding score: -15.508
InChIKey:GAXWPLILXKHYDD-UHFFFAOYSA-N
ID: 80748
SMILES:O1C2c3c(O)cc(CCCCC)cc3OC2C=C(C)CCC2C1(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.401
InChIKey:BHEKWWCZNUYZDL-UHFFFAOYSA-N
ID: 80749
SMILES:CC1(C)C=CC2(C)Oc3c(c(OC)cc(CCC)c3)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -15.912
InChIKey:MFTQJMZTIDLAFK-UHFFFAOYSA-N
ID: 80750
SMILES:C(CCC)Cc1cc2c(c(O)c1)C=CC(C)(CCC=C(CCC=C(C)C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -19.944
InChIKey:PXPDKUHGJIMKBA-UHFFFAOYSA-N
ID: 80751
SMILES:C(c1cc(O)c(CC=C(C)CCC=C(C)C)c(O)c1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 314.469
CB1 binding score: -18.27
InChIKey:PBVXSNIWCHRXCN-UHFFFAOYSA-N
ID: 80752
SMILES:CC1(CCC=C(C)C)C2C(OC)Oc3c2c(cc(CCCCC)c3)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -12.624
InChIKey:OTLHBMLEQVJRBB-UHFFFAOYSA-N
ID: 80753
SMILES:CC1Oc2c(c(O)cc(CCCCC)c2)C2=C(C(=O)C3(C(C)C2)C(C)(C)CCC3)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.581
CB1 binding score: -15.552
InChIKey:OLCNVEITFHDELF-UHFFFAOYSA-N
ID: 80754
SMILES:C1(C=O)CCC(C(C)=C)C(c2c(O)cc(CC)cc2OC)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -13.949
InChIKey:BUYCSCGBRUJLLU-UHFFFAOYSA-N
ID: 80755
SMILES:C1(C)(C)Oc2cc(CCCCC)cc(OC)c2C2CC(C)CCC12O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -15.897
InChIKey:NGLYXGXBTPGSFB-UHFFFAOYSA-N
ID: 80756
SMILES:C1CC(C)C(O)=C2C3c4c(O)cc(CCC)cc4OC(C)(C)C3CCC12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -15.67
InChIKey:PDHAZSKTTOBNNO-UHFFFAOYSA-N
ID: 80757
SMILES:O=C(c1c(O)c2c(cc1O)OC(C)(C)C1C2C(OC)(C)CC1)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -15.29
InChIKey:VLFLSNBYMOGFKS-UHFFFAOYSA-N
ID: 80758
SMILES:C12C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C1CC(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 80759
SMILES:C1(C)=CC(c2c(CCCCC)cc(O)cc2O)OC(C)(CCC=C(CCC=C(C)C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.668
CB1 binding score: -15.005
InChIKey:YOPLMMYMZXETQI-UHFFFAOYSA-N
ID: 80760
SMILES:CC1(C)Oc2cc(CCC)c(C(O)=O)cc2C2(C)C1CCC(O)(C)C2O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -14.326
InChIKey:NRMCCHPEVBEQNW-UHFFFAOYSA-N
ID: 80761
SMILES:C1CC2(CCC(O)C1C)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -15.221
InChIKey:JBGVLKIDLQMTQG-UHFFFAOYSA-N
ID: 80762
SMILES:c1(CC=C(C)CCC=C(C)C)c(O)c(CCc2cc(O)c(CC=C(C)C)c(O)c2)cc(O)c1
Pathway: Polyketides;Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids;Stilbenoids
Class: Cannabinoids;Monomeric stilbenes
MW: 450.619
CB1 binding score: -15.514
InChIKey:ITNKGXSQDSGXKR-UHFFFAOYSA-N
ID: 80763
SMILES:C(C1(C)Oc2c(O)cc(C)cc2CC1c1cc(O)ccc1O)CC(C(C)(C)O)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.487
CB1 binding score: -11.084
InChIKey:HJWACFRGUXTJNX-UHFFFAOYSA-N
ID: 80764
SMILES:C12(C)CCCC(C)=C1C(=O)c1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -16.672
InChIKey:GYRVEZCEKBTHDV-UHFFFAOYSA-N
ID: 80765
SMILES:C(CCCC)Cc1cc2c(c(O)c1)C1C(CCC(C)(O)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -17.427
InChIKey:UTXVBEHMQGNODO-UHFFFAOYSA-N
ID: 80766
SMILES:C1(O)CCC2Oc3c(c(O)cc(CCCCC)c3)C2C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -15.531
InChIKey:DRVIDPXTGXWLIR-UHFFFAOYSA-N