ID: 50254
SMILES:CC1(C)Oc2c(c(OC)cc(CCCCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.348
InChIKey:FJRQDVCLUUZSIG-UHFFFAOYSA-N
ID: 50255
SMILES:C1(C)(C)C2CCC(=O)C=C2c2c(cc(CCC)cc2O)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -17.988
InChIKey:DAXTVMKBQOBDRH-UHFFFAOYSA-N
ID: 50256
SMILES:C(CCC)c1c2c(ccc1C)C1C(CCC)C(C(=O)O)(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -15.624
InChIKey:DOTSRFOTAZFTDE-UHFFFAOYSA-N
ID: 50257
SMILES:CC(=O)c1c(O)c(C=O)c2c(c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.381
CB1 binding score: -15.211
InChIKey:SJXPUASTRJPOPI-UHFFFAOYSA-N
ID: 50258
SMILES:c1(CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC=C(CCC=C(C)C)C)ccccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 474.729
CB1 binding score: -14.443
InChIKey:SHSFNDJTDUWXEB-UHFFFAOYSA-N
ID: 50259
SMILES:Cc1c(OC)c2c(cc1CCCCC)OC(C)(C)C2CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -17.068
InChIKey:RXJDQPQISXWTJD-UHFFFAOYSA-N
ID: 50260
SMILES:C(Cc1c(O)cc(CCCCC)c(C(=O)O)c1O)=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 50261
SMILES:c1(CCCC)c(C)c2c(c(O)c1)C1=C(C(C)(C)O2)CCC(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.712
InChIKey:CMDIPERBZFACSV-UHFFFAOYSA-N
ID: 50262
SMILES:Oc1c2c(c(O)cc1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -18.988
InChIKey:FDECQIAQAVZRFF-UHFFFAOYSA-N
ID: 50263
SMILES:C12CC(=C)CCC1C(C)(C)Oc1cc(CCCCC)cc3c1C2CC(C)C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.589
CB1 binding score: -12.481
InChIKey:TWLNKLVOZIMTPM-UHFFFAOYSA-N
ID: 50264
SMILES:c1(O)c2c(c(C(C(C)CO)=O)cc1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -11.814
InChIKey:JGONIDXCTDEYTD-UHFFFAOYSA-N
ID: 50265
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C(C(=C)C)CCC12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.819
InChIKey:KAMBAVCQZNPQOI-UHFFFAOYSA-N
ID: 50266
SMILES:OC(CO)c1c(C(O)=O)c(CCCCC)cc2c1CC(C(C)(CCC=C(C)C)O)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.546
CB1 binding score: -13.679
InChIKey:CLZUSZQDYMAOPV-UHFFFAOYSA-N
ID: 50267
SMILES:C1=C(C)CC2C(C(C)(C)Oc3c2c(OC)cc(OC)c3OC(=O)CCC)C(O)C2C(C)(CC1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 474.594
CB1 binding score: -11.325
InChIKey:RQSIWHYJVSTMIT-UHFFFAOYSA-N
ID: 50268
SMILES:CC(C)=CCCC(=CCc1c(O)c(C(O)=O)c(CCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -18.957
InChIKey:BBTJGOMWXQQCKF-UHFFFAOYSA-N
ID: 50269
SMILES:Cc1c(CCCCC)c(O)c2c(c1O)OC(C)(C)C1C2C=C(C)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.491
InChIKey:RNJOKEHDKKLEKG-UHFFFAOYSA-N
ID: 50270
SMILES:C(CCc1cc2c(c(O)c1)C1C=C(CO)CCC1C(C)(C)O2)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -15.929
InChIKey:SXUWUFQNQQFSSY-UHFFFAOYSA-N
ID: 50271
SMILES:CC12C(=C(O)C(=O)c3c(cc(CCCCC)cc3O)O1)CC(C)(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.356
InChIKey:IVIJRQLRLJXTQQ-UHFFFAOYSA-N
ID: 50272
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)-c2cc(O)cc(C)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -17.098
InChIKey:CYYBJMFYWOOUPL-UHFFFAOYSA-N
ID: 50273
SMILES:CC12Oc3c(c(OC)cc(CCCC)c3)C(O)C1C(C(CCC=C(C)C)C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -16.513
InChIKey:PCGMAAISDSSIJD-UHFFFAOYSA-N
ID: 50274
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(CCC=C(C)C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.791
InChIKey:ORKZJYDOERTGKY-UHFFFAOYSA-N