ID: 127198
SMILES:C(CC)CCc1cc(OC(C)=O)c(CC=C(C)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -18.767
InChIKey:OGCCABVUOZBTQV-UHFFFAOYSA-N
ID: 127199
SMILES:c12c(O)c(O)cc(CCCCC)c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.567
InChIKey:CTKUEOAABUEXHK-UHFFFAOYSA-N
ID: 127200
SMILES:C1=C(C)CCC2C1c1cc(Br)c(C)cc1OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 321.258
CB1 binding score: -18.671
InChIKey:RPVWNWGEPFZWQS-UHFFFAOYSA-N
ID: 127201
SMILES:OC1(C)CC2c3c(cc(CCCCC)cc3OC2(C)C)OC1C=CC(C)(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -14.767
InChIKey:IOPZTBZVMRBCFZ-UHFFFAOYSA-N
ID: 127202
SMILES:C1(C)=CC(c2c(O)cc(CCC)cc2O)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 127203
SMILES:O1C(C)(C)CC(c2c(OC)c(O)cc(CCCCC)c2)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.419
CB1 binding score: -14.041
InChIKey:GQCMVQYREGWQBR-UHFFFAOYSA-N
ID: 127204
SMILES:CC1C(C=C(C)C)C2CCC(O)(C)C2C(c2c(O)cc(CCCCC)cc2O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -14.199
InChIKey:YLCFYVGEMWMHNA-UHFFFAOYSA-N
ID: 127205
SMILES:CCCc1cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 127206
SMILES:c1(O)cc(CC2C(C)(OCC=C(C)CCCC(CCC=C(C)C)C)CC=C(C)C2)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.695
CB1 binding score: -15.055
InChIKey:ONTFECVEHDRNSO-UHFFFAOYSA-N
ID: 127207
SMILES:C1(C)=CC(c2c(OC)cc(OC)c(O)c2C=O)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -15.428
InChIKey:CTSYCFZBEFWKMN-UHFFFAOYSA-N
ID: 127208
SMILES:C1CC(C(=C)C)C(c2c(O)cc(OC)cc2Br)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 337.257
CB1 binding score: -14.317
InChIKey:VHVFIDPBDRUYOK-UHFFFAOYSA-N
ID: 127209
SMILES:C1CC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2CC1C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.539
CB1 binding score: -17.334
InChIKey:YVGPLIXPKCYPNT-UHFFFAOYSA-N
ID: 127210
SMILES:c12c(cc(CCCCC)cc1OC)OC(CCC(C)=O)(C)CC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -15.331
InChIKey:FUJCMSYLODFLOG-UHFFFAOYSA-N
ID: 127211
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)C=C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.727
InChIKey:YLTWYAXWDLZZCU-UHFFFAOYSA-N
ID: 127212
SMILES:C1(=O)C(C)=C2C(OCC)(c3c(O)cc(CCCCC)cc3OC2(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -12.908
InChIKey:FCIFVCGAJUSKLR-UHFFFAOYSA-N
ID: 127213
SMILES:Brc1c(Br)cc2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.127
CB1 binding score: -16.206
InChIKey:IPAFMPQFMREKTE-UHFFFAOYSA-N
ID: 127214
SMILES:O=CC(c1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -17.672
InChIKey:NOCANYORFJKYIY-UHFFFAOYSA-N
ID: 127215
SMILES:O1c2c(c(O)c(C(=O)O)c(CCCCC)c2)C(c2ccccc2)C1CC=C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.511
CB1 binding score: -12.769
InChIKey:SCJSDASPMSPUPR-UHFFFAOYSA-N
ID: 127216
SMILES:C(CCO)c1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.758
InChIKey:TXVRIJHVLPFPMD-UHFFFAOYSA-N
ID: 127217
SMILES:CC1(C)C2CCC(C)=CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 127218
SMILES:CC(C1C(c2c(O)cc(CCCCC)cc2O)CC(C)=CC1)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -17.733
InChIKey:GDJHOFOXIAXVST-UHFFFAOYSA-N