ID: 100234
SMILES:O=C(C)Oc1cc(CCCCC)cc(O)c1C1CC(C)CCC1(O)C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.537
CB1 binding score: -13.423
InChIKey:MJIZEPLYTRBDMA-UHFFFAOYSA-N
ID: 100235
SMILES:Oc1cc(CCCC)cc(O)c1C1C(C(=C)CO)CCC(C)(O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 336.428
CB1 binding score: -12.372
InChIKey:UWQNXMUTMXKESD-UHFFFAOYSA-N
ID: 100236
SMILES:C1C2c3c(c(O)c(C)cc3OC1(C)C)C#CC(C)=CC1C(C(C)=C)CCC3(C)OC3CC1=C2C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.642
CB1 binding score: -12.547
InChIKey:BTIBNBFZYCDLLR-UHFFFAOYSA-N
ID: 100237
SMILES:C1OCC2(CC(c3ccccc3)=O)C(O1)c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.456
CB1 binding score: -13.783
InChIKey:VYYZDPPWJFVALF-UHFFFAOYSA-N
ID: 100238
SMILES:C1(C=C(C)C)(OC)C=C(C)CC1c1c(O)cc(CCCCC)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -12.088
InChIKey:QXXWBZDODMCWHK-UHFFFAOYSA-N
ID: 100239
SMILES:c1(CCCC)cc(O)c(C2CC(=C)CCC2C(CCC=C(C)C)C)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: Not available
InChIKey:XMCBVAQWOHBGON-UHFFFAOYSA-N
ID: 100240
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C3C(C(=C)C)CCC1(C)C2CC=C(C)C3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.6
CB1 binding score: -15.487
InChIKey:FKEOUMGLOGWMMF-UHFFFAOYSA-N
ID: 100241
SMILES:O1c2cc(CCCCC)cc(OCC3(C)C4CCC=C(C)C4(C)CCC3C)c2OC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -15.368
InChIKey:INOFWGQWRYWLRK-UHFFFAOYSA-N
ID: 100242
SMILES:C12=CC(OC1=O)C(C(=C)C)Cc1c(CCCCC)cc(O)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.408
CB1 binding score: -13.862
InChIKey:XBKNUWPBRKEBEK-UHFFFAOYSA-N
ID: 100243
SMILES:c1c(O)ccc(C2=C(C(Cc3ccccc3)(CCCC(C)C)C)C(O)C(C)(C)O2)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.582
CB1 binding score: -14.196
InChIKey:KULVMMLLPDWURU-UHFFFAOYSA-N
ID: 100244
SMILES:O(C)C(=O)C1=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.943
InChIKey:CCMWHLPOQSRJEP-UHFFFAOYSA-N
ID: 100245
SMILES:Oc1cc(CCCCC)cc2c1C1C(C(C)(O)CCC1C(CCC=C(C)C)=C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -16.21
InChIKey:JVZOZZUGRKCFIN-UHFFFAOYSA-N
ID: 100246
SMILES:C(CCCC)c1cc(O)c(CC=C(C)C(O)CC=C(C)C)c(O)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.334
InChIKey:PXMMOISCSOLPFY-UHFFFAOYSA-N
ID: 100247
SMILES:c12c(c(O)cc(CCCCCC)c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -20.649
InChIKey:ZHYPKENABBMAAN-UHFFFAOYSA-N
ID: 100248
SMILES:C(c1cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N
ID: 100249
SMILES:C1C2C(CC(O)C1=C)C(C)(C)Oc1c2c(O)ccc1OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.359
CB1 binding score: -15.349
InChIKey:KTQUGGNIKQVBSP-UHFFFAOYSA-N
ID: 100250
SMILES:O1c2c(c(OC)cc(CCCC)c2)C2C1(C)CCC2C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -15.906
InChIKey:JZOUEICNHPRMNS-UHFFFAOYSA-N
ID: 100251
SMILES:C(CCC)CCc1cc(O)c(CC=C(C)CCC=C(C)C)c(O)c1C1C(O)C(C)(O)CCC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.666
CB1 binding score: -13.452
InChIKey:VNLLGKWKCGUUTD-UHFFFAOYSA-N
ID: 100252
SMILES:c12c3c4c(ccc3cc(C(CC)C)c1)OC(C)(C)C1C2C=C(C)CC41
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.487
CB1 binding score: -14.605
InChIKey:BQYDNYPRVBDBNY-UHFFFAOYSA-N
ID: 100253
SMILES:C1=C(CO)C(O)CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.967
InChIKey:XTDYIISRNODHHT-UHFFFAOYSA-N
ID: 100254
SMILES:O1c2cc(O)cc(CCCCC)c2C2C3=C(CC1(C)C(C)CCC=C(C)C)OC3C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.69
CB1 binding score: -12.026
InChIKey:POMVFLXYKXRVPZ-UHFFFAOYSA-N