ID: 127366
SMILES:C(C)(C)=CCc1c(Oc2cc(CCCCCC)cc(O)c2CC=C(C)C)cc(CC=C(C)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 558.847
CB1 binding score: -14.883
InChIKey:XGAIEPUXOFFZRJ-UHFFFAOYSA-N
ID: 127367
SMILES:c12c(O)cc(CCC(=O)C=C)cc1OC(CC)(C)CC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -16.383
InChIKey:IZHBVCJKYMPAJD-UHFFFAOYSA-N
ID: 127368
SMILES:C12c3c(O)cc(CCCCC)cc3OC(C)(C)C1CCC1(C)OC1C1C(C(C)=CC2=O)C2OC1(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 508.699
CB1 binding score: -12.747
InChIKey:NSXGXTMCOMKMKP-UHFFFAOYSA-N
ID: 127369
SMILES:c1c2c(c(O)cc1CC=C(C)CCC=C(C)C)CC(O)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -14.605
InChIKey:PDHWKUZHTSICNA-UHFFFAOYSA-N
ID: 127370
SMILES:C1C(C(C)=C)C(c2cc(CCCCC)cc(O)c2)CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -16.993
InChIKey:UJDULBLXJFNKOT-UHFFFAOYSA-N
ID: 127371
SMILES:c1(CCCCC)c(C(=O)O)c(O)c(C2C(C(C)=CCC=C(C)C)CC(O)C(C)=C2)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -13.605
InChIKey:SZDKCNAAWVFQMI-UHFFFAOYSA-N
ID: 127372
SMILES:C1(C(=O)CC(C)(C)O)(C)C2C(CC(C)=CC2)c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -13.826
InChIKey:QPMLPMUFZGEVLD-UHFFFAOYSA-N
ID: 127373
SMILES:C1(C)(C)Oc2cc(C)cc(O)c2C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 127374
SMILES:CC1(C)C2CC1c1c(OC)cc(CCCCC)cc1OC2=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -15.838
InChIKey:AVBVEHIUNXKBAL-UHFFFAOYSA-N
ID: 127375
SMILES:O=C1C2(O)c3c(O)cc(CCCCC)cc3OC(C)(CCCC(C)(O)C)C2CCC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.601
CB1 binding score: -11.745
InChIKey:WJKIUWVWMAZTFO-UHFFFAOYSA-N
ID: 127376
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C1CCC(CO)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 127377
SMILES:CC(=C1CC(C)=CC(c2c(O)cc(CCCCC)cc2O)C1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.346
InChIKey:XJIGOMOORXCYNJ-UHFFFAOYSA-N
ID: 127378
SMILES:C1(C)=CC(c2c(O)cc(CCC)cc2O)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 127379
SMILES:C(C)(C)(CCCC(=C)C)C1Cc2c(O)cc(C)cc2OC12C=CC(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -15.374
InChIKey:DMBCESJKAPHPIO-UHFFFAOYSA-N
ID: 127380
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1C2CCC(C)=C1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -15.367
InChIKey:TXYOCVUFIZPGLO-UHFFFAOYSA-N
ID: 127381
SMILES:C(C(C)=CCCC(C)=CCc1c(O)c2c(cc1O)C(=S)[N]CC(C)O2)C1C=C(C)CCC1C(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.721
CB1 binding score: -17.176
InChIKey:HBHJWBNIHKAPEV-UHFFFAOYSA-N
ID: 127382
SMILES:CC12CC(c3c(O)cc(CCC)cc3O1)C(O)C(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.375
CB1 binding score: -15.043
InChIKey:WVAZOVUPBFVTRY-UHFFFAOYSA-N
ID: 127383
SMILES:C(C1(O)CCC2CC1c1c(O)cc(CCC)cc1OC2(C)C)(O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.412
CB1 binding score: -11.756
InChIKey:XVVDRXCCBRVBJR-UHFFFAOYSA-N
ID: 127384
SMILES:C(C(C)=CCc1cc(OC)cc(C)c1O)CC=C(C=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -18.271
InChIKey:LTUYWLMIHKGWJM-UHFFFAOYSA-N
ID: 127385
SMILES:c1(C=CC)cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -17.329
InChIKey:UXMYALNHHLVVAU-UHFFFAOYSA-N
ID: 127386
SMILES:C(=CCCC(C)c1c2c(c(C)cc1O)C1C(C(C)(CO)O2)CCC(C)=C1)C(C)OC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: -15.23
InChIKey:ZNQGXSRMWRSNIW-UHFFFAOYSA-N