ID: 93157
SMILES:c1c(CCCCCC)cc2c(c1O)C1C(CCC(CO)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -18.264
InChIKey:JSQZQNWIVUSPJH-UHFFFAOYSA-N
ID: 93158
SMILES:C1(O)CC(C=O)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CCC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -16.502
InChIKey:VUNFYLDBDCMEDY-UHFFFAOYSA-N
ID: 93159
SMILES:CC1(CCCCCCCC)Oc2c(c(O)cc(C)c2)C=C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -16.955
InChIKey:GLSXPRUBGNMHBS-UHFFFAOYSA-N
ID: 93160
SMILES:C1(O)(C)CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 93161
SMILES:C12(C)C(CCC3(C)C1Cc1c(cc(O)c4c1C(=O)C(NCC(O)C)=C(C)C43)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 397.515
CB1 binding score: -15.519
InChIKey:HZXHLGQGFSFMLD-UHFFFAOYSA-N
ID: 93162
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(C(O)(C)C)CCC(C)(O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.841
InChIKey:UKPNRAMYBFBWKV-UHFFFAOYSA-N
ID: 93163
SMILES:C1C(C(C)C)C2c3c(cc(CCCCC)cc3O)OC(CO)(O2)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -15.581
InChIKey:QXCAMYMXWKFCAG-UHFFFAOYSA-N
ID: 93164
SMILES:C(O)(CCC=C(CO)CO)(C)CCCC1=CC(c2c(O)cc(CCCCCO)cc2O)OC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.582
CB1 binding score: -16.616
InChIKey:ANJSLHNFBMUKPG-UHFFFAOYSA-N
ID: 93165
SMILES:C1C(=CCc2c(O)c(C(O)=O)c(CCCCC)cc2O)C(C)(C)CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.678
InChIKey:KBNIDPRPKBMDQG-UHFFFAOYSA-N
ID: 93166
SMILES:C1C2C(C(C)(C)CC1)c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -18.99
InChIKey:BUERTDPBRJDURX-UHFFFAOYSA-N
ID: 93167
SMILES:c1(OC)c(OC)c(O)c(C(CC(C)C)OC(=O)CCCCCCCCCCCCCCC)c(C=O)c1c1cc(O)c(C2C=C(C)CCC2C(C)=C)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 733.043
CB1 binding score: -14.455
InChIKey:BXKGHQOUIPGWFT-UHFFFAOYSA-N
ID: 93168
SMILES:C=CCC=Cc1cc2c(c(O)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -15.564
InChIKey:VGBOLQTYBLZBLR-UHFFFAOYSA-N
ID: 93169
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(CC=C(C)C2)C(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -14.767
InChIKey:WNFYFRANPVTOSP-UHFFFAOYSA-N
ID: 93170
SMILES:C12C(CS(=O)(=O)c3c(C)cc(=O)oc31)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.538
CB1 binding score: -15.666
InChIKey:ROLVNJGOMWQYPP-UHFFFAOYSA-N
ID: 93171
SMILES:CC1(C)C2C(C)(CC1)Oc1c(c(OC)cc(C(CCCCC)O)c1O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -17.861
InChIKey:BDDXJYVUWPXYBO-UHFFFAOYSA-N
ID: 93172
SMILES:C1C23C(C(C)(C)CCC2)c2c(cc(CCCCC)cc2O)OC(C)(C1)C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -15.116
InChIKey:BWXHNMKHPXWQJX-UHFFFAOYSA-N
ID: 93173
SMILES:CC1(C)OC1C(c1c(O)cc(CCCCC)cc1)C=C(C#CC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.545
CB1 binding score: -14.063
InChIKey:PRLXNTUOBUGROO-UHFFFAOYSA-N
ID: 93174
SMILES:Oc1c2c(c(C(C(CC)C)=O)c(O)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.453
InChIKey:NIZQVFOBIVYVBJ-UHFFFAOYSA-N
ID: 93175
SMILES:C(CCCC)Cc1cc(O)c2c(c1)OC(C)(C)C1CC=C(CO)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -18.585
InChIKey:NZUUGMLOXJAJLR-UHFFFAOYSA-N
ID: 93176
SMILES:c1cc(O)cc2c1C1C(CC(O)C(C)=C1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -16.502
InChIKey:BZSSWQQQVIVOHR-UHFFFAOYSA-N
ID: 93177
SMILES:CCCCCc1cc2c(c(OC)c1)C1C(=O)C(C)(C)OC1(C)C1=C(C(COC(C)=O)C)CCC1(O)C(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 524.698
CB1 binding score: -16.4
InChIKey:GTTOFUKNVNPJQA-UHFFFAOYSA-N