ID: 61027
SMILES:C1(C)CCC(C(C)C)C(c2c(O)cc(CCCCC)cc2OC)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.528
CB1 binding score: -18.883
InChIKey:KKBNGEMFBFEYQN-UHFFFAOYSA-N
ID: 61028
SMILES:c1(O)c(C(CC(C)C)=O)c2c(c(O)c1)-c1cc(CCCCC)cc(O)c1C1CC(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 508.699
CB1 binding score: -15.058
InChIKey:RYPAGBOBIZWFFQ-UHFFFAOYSA-N
ID: 61029
SMILES:OC(C(=O)c1cc2c(c(O)c1)C1C(CCC(CO)=C1)C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.396
CB1 binding score: -15.195
InChIKey:DXKXFZKXRQUPKS-UHFFFAOYSA-N
ID: 61030
SMILES:c1(O)c2cc3c4c(c2cc(CC=C(C)CCC=C(C)C)c1-4)OC(C)(C)C1C3C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.616
CB1 binding score: -15.348
InChIKey:GOWRLZFAZFYJFH-UHFFFAOYSA-N
ID: 61031
SMILES:CC1(C)CC(=O)CC2(C)Oc3c(cc(CCCCC)cc3O)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.707
InChIKey:FXJAOZHBDNDMLF-UHFFFAOYSA-N
ID: 61032
SMILES:O=C1c2c(CCCCC)cc(O)cc2OC(C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -16.265
InChIKey:PWPPSFRDUAVFOA-UHFFFAOYSA-N
ID: 61033
SMILES:c1(O)cc(CCCCC)cc2c1C1C(C(C)(OC)C)CCC(C)(O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -17.388
InChIKey:SPQILLGTJLAJPN-UHFFFAOYSA-N
ID: 61034
SMILES:C1(C)(C)Oc2c(c(OC)cc(O)c2)CC2C1CCC(C)=C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -14.534
InChIKey:DEMUEUGDIWJLBG-UHFFFAOYSA-N
ID: 61035
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(=C(C)C)C(C=C(C)C)CC(C)C1CCC2C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.67
CB1 binding score: -13.807
InChIKey:KWVRYXIZMOXEPX-UHFFFAOYSA-N
ID: 61036
SMILES:O=C(OC1C(C(C)C)CCC2(C)Oc3c(c(O)cc(CCCCCC)c3)C12)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -16.581
InChIKey:HHDXVYOZMBAOEU-UHFFFAOYSA-N
ID: 61037
SMILES:C1C(C)=CC2C(C(C)(C)Oc3c2c(O)cc(OC)c3CC=C(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.591
InChIKey:HZGJGYLHBYJMKM-UHFFFAOYSA-N
ID: 61038
SMILES:C1(C)=CC(c2c(O)cc(CCCCC)cc2OC)C(C(c2ccccc2)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.583
CB1 binding score: -14.498
InChIKey:ZGUZRJZQWVXJAV-UHFFFAOYSA-N
ID: 61039
SMILES:C(C)(C1C=CC(C)=CC1c1c(O)cc(CCCCC)cc1O)=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -15.115
InChIKey:JWDFSMLOFIILJJ-UHFFFAOYSA-N
ID: 61040
SMILES:C1(C)(C)Oc2cc(CCCCC)c(C(=O)O)c(O)c2C2=C1CC(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.438
InChIKey:WBBMOBLAKHMWBI-UHFFFAOYSA-N
ID: 61041
SMILES:C(CNC(=O)C)=C(Cc1cc(C2C(C(=C)C)CCC(C)=C2)c(O)c(C=O)c1O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 397.515
CB1 binding score: -14.222
InChIKey:HVLGVLLWTABXIT-UHFFFAOYSA-N
ID: 61042
SMILES:C12CC(C)=CCC1C(C)(C)Oc1c2ccc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -18.541
InChIKey:DXDRGIVLXHOGHC-UHFFFAOYSA-N
ID: 61043
SMILES:Oc1c2c(c(CCCCC)cc1O)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.585
InChIKey:HSSWXEGGDNCSBM-UHFFFAOYSA-N
ID: 61044
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1CCC=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.512
InChIKey:XOQSHLSGLMYIAN-UHFFFAOYSA-N
ID: 61045
SMILES:CC1=CC(c2c(O)ccc(CCNC(=O)C)c2)C(C(=C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 313.441
CB1 binding score: -16.403
InChIKey:XVUJPLOCBMNYRN-UHFFFAOYSA-N
ID: 61046
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 61047
SMILES:c1c(CCCC)c(C)c2c(c1)OC(C)(C)C1C(C2)C=C(C=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -13.047
InChIKey:ISHRFCLLXQRVKT-UHFFFAOYSA-N