ID: 37066
SMILES:CC(O)(C1CCC(C)=CC1c1c(O)cc(CC)cc1OC=C(C)CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -11.771
InChIKey:JJRJMFLNXCKANN-UHFFFAOYSA-N
ID: 37067
SMILES:C1(C)(O)C(Br)CC=C(C)CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 493.526
CB1 binding score: -11.51
InChIKey:CQOIQTOGDUGZBI-UHFFFAOYSA-N
ID: 37068
SMILES:c1(CCCC)ccc(O)c(CC=C(C)CCC=C(C)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -18.107
InChIKey:MIXCUUCNJULULK-UHFFFAOYSA-N
ID: 37069
SMILES:C1(C)=CC2C(C(C)(C)Oc3c2c(O)cc(CCCCC=CCC)c3)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -16.837
InChIKey:KDZDIEFQASBXQA-UHFFFAOYSA-N
ID: 37070
SMILES:CC(=CCc1c(OC)c(CCCCC)cc(O)c1)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -16.939
InChIKey:LOXIJZODUCQESR-UHFFFAOYSA-N
ID: 37071
SMILES:C(C)(C)=CCc1cc(C(=O)O)cc2c1OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 340.463
CB1 binding score: -16.442
InChIKey:KLGQPEOPYLTLOU-UHFFFAOYSA-N
ID: 37072
SMILES:c1(CCCCC)cc2c(c(O)c1)C1CC(C)(O2)CCC1(C(C)C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.712
InChIKey:CQNNULQPTCZJME-UHFFFAOYSA-N
ID: 37073
SMILES:C(c1c(O)cc2c(c1)OC(C)(C)C1CCC(C)=CC12)C=C(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -16.813
InChIKey:CFDJNJRNPRDHMH-UHFFFAOYSA-N
ID: 37074
SMILES:O1c2c(c(O)cc(CCCCC)c2)C23C(C)CC4(OC1=O)C2=C(C(=O)C(C)C4)C=C(C)C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.548
CB1 binding score: -16.799
InChIKey:YKGKNASDKZJOQL-UHFFFAOYSA-N
ID: 37075
SMILES:CC1(C)C2CCC(C)C=C2c2c(c(O)cc(CCC)c2)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -14.26
InChIKey:BIFYCQLDSHJSJS-UHFFFAOYSA-N
ID: 37076
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.471
CB1 binding score: -19.804
InChIKey:VGBLUPCGCQUYRW-UHFFFAOYSA-N
ID: 37077
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 37078
SMILES:C=CCc1c(O)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -16.49
InChIKey:MQZCNZNVIXSGTB-UHFFFAOYSA-N
ID: 37079
SMILES:O=C(C(C(C)C(C(CC)C)C)O)c1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -15.929
InChIKey:DKXJUZGQMBBQRE-UHFFFAOYSA-N
ID: 37080
SMILES:CC1(OC2c3c(cc(CCCCC)cc3O)OC2C=C(C)CCC=C(C)C)CCOC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -13.438
InChIKey:RELUNIWTINPKGZ-UHFFFAOYSA-N
ID: 37081
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1=C2C(O)C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.21
InChIKey:QATRADYGJXWTPV-UHFFFAOYSA-N
ID: 37082
SMILES:Oc1cc(CCCC)c(C2C=C(C)CCC2C(C)=C)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -14.591
InChIKey:DRYXTUKCDJHNCQ-UHFFFAOYSA-N
ID: 37083
SMILES:C1=C(C)CCC2C(C)(C)Oc3cc(CCc4ccccc4)c(O)c(C(C)C)c3C2C1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.593
CB1 binding score: -15.462
InChIKey:YHLPZTVLIUDREP-UHFFFAOYSA-N
ID: 37084
SMILES:C1(O)C(C(C(CC)C)=O)C(CC(O)=O)=CC(CC(C)=CCc2cc(O)cc(C)c2O)C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.595
CB1 binding score: -14.817
InChIKey:OMURUNPKCNKEPX-UHFFFAOYSA-N
ID: 37085
SMILES:c1(CCCCCCCC)cc2c(cc1CCC)C(=O)OC(C)(C)C1C2C(O)C(O)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.656
CB1 binding score: -14.861
InChIKey:QANMSLIWFBIFDB-UHFFFAOYSA-N
ID: 37086
SMILES:C=C(C)C1C(c2c(O)cc(CCCC)cc2O)CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -16.289
InChIKey:UJQVSFLXIHFWCQ-UHFFFAOYSA-N