ID: 111133
SMILES:C1C(C(C)=C)C2c3c(cc(CCCCC)c(C=O)c3O)OC2C(C(C)C)=C1C(O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.526
CB1 binding score: -14.254
InChIKey:KFCLGTQYFMHJNZ-UHFFFAOYSA-N
ID: 111134
SMILES:C(=CC(C)C(c1c(O)c2c(c(OC)c1)OC(C)(C)C1C2CC(C)=CC1)=O)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.527
CB1 binding score: -16.506
InChIKey:MAVMQAICWJEHCE-UHFFFAOYSA-N
ID: 111135
SMILES:C(=C(C)C)CCC(C(=O)O)=CCCC(=CCc1c(O)cc(CCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Merosesquiterpenoids
MW: 386.532
CB1 binding score: -16.879
InChIKey:PTXYTNIYEDHRBG-UHFFFAOYSA-N
ID: 111136
SMILES:Oc1c(C2C=C(C)CCC2C(=C)C)c(C)cc(O)c1C(C=C)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.519
InChIKey:QFWIIMSTVAFHOR-UHFFFAOYSA-N
ID: 111137
SMILES:C(CC1(C)C(=C(C)C)CC(=O)C(C)=CC1c1c(O)cc(CCC)cc1O)C(C(C)=C)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.581
CB1 binding score: -14.646
InChIKey:BSVLWUBDLOEALI-UHFFFAOYSA-N
ID: 111138
SMILES:O=C(OC(CC)c1c(OC)c(OC)c(C2C=C(C)CCC2C(=C)C)c(O)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -16.502
InChIKey:YYMZQXVOIRGAME-UHFFFAOYSA-N
ID: 111139
SMILES:O1c2cc(CCCCC)cc(O)c2C(=O)C2C1(C)CCC(O)C2(OC(=O)CCC)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.53
CB1 binding score: -12.808
InChIKey:PRHJAGVQICLORL-UHFFFAOYSA-N
ID: 111140
SMILES:OC1=CC(C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -17.24
InChIKey:YULOTQRFXFPRIH-UHFFFAOYSA-N
ID: 111141
SMILES:C(C)(C1CCC(C)=CC1c1c(CCl)cc(O)cc1O)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.806
CB1 binding score: -12.769
InChIKey:YZHPOQBUHFTBEN-UHFFFAOYSA-N
ID: 111142
SMILES:CC1Cc2c(c(O)cc(CCCCC)c2)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.459
CB1 binding score: -16.543
InChIKey:RCAWDNSEFNQLHP-UHFFFAOYSA-N
ID: 111143
SMILES:C1(=O)C2=CC(C)(C)CC2C2(C)C(C)(C1)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -16.229
InChIKey:BRNPVNKAGSZNOC-UHFFFAOYSA-N
ID: 111144
SMILES:C1(C(CCNC)=C)CC(O)C(C)=CC1c1c(O)c(CC=C(CCC=C(C)C)C)cc(OC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 453.667
CB1 binding score: -16.368
InChIKey:KNQHLHKEILMSOI-UHFFFAOYSA-N
ID: 111145
SMILES:C1(C)(C)Oc2cc(CCCCC)cc(O)c2C2C1C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.096
InChIKey:OPOIPENSMKDQLW-UHFFFAOYSA-N
ID: 111146
SMILES:C1C(C)(O)C(CC2OC2(C)C)Oc2cc(C(=O)O)cc(CCCCC)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -12.561
InChIKey:ITNCMYWLKFMUEZ-UHFFFAOYSA-N
ID: 111147
SMILES:CC12c3c(O)cc(CCCCC)cc3OC(C)(C)C1CCC(C)=CC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -16.191
InChIKey:AEKGBTPIPIXTOL-UHFFFAOYSA-N
ID: 111148
SMILES:CC(C1CCC(C)=CC1c1cc(CCNC)ccc1OC)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 299.458
CB1 binding score: -18.57
InChIKey:ZKBBKDQCHSPYPC-UHFFFAOYSA-N
ID: 111149
SMILES:c1c(CCCCC)c(CC=C(C)C)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.589
CB1 binding score: -15.546
InChIKey:SCGWRULEYBYAHF-UHFFFAOYSA-N
ID: 111150
SMILES:c12c(cc(CCCCC)cc1OC)OC(CCC=C(C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.06
InChIKey:KSDSETBZUIJIFF-UHFFFAOYSA-N
ID: 111151
SMILES:C1C(C(C)=C)C(c2c(O)ccc(CCCCC)c2)C=C(C)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -16.35
InChIKey:XQOKAGQXIFFJOL-UHFFFAOYSA-N
ID: 111152
SMILES:C1CC(C)=CC2c3c(cc(CCC)cc3O)OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 111153
SMILES:C1C(CO)=CCc2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -12.103
InChIKey:KLFPUIXWGGVCAE-UHFFFAOYSA-N