ID: 77239
SMILES:CC1=C(c2c(O)c3c(cc2OC)OC(CCC=C(C)C)(C)C=C3)OC(C)(C)C(O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -16.425
InChIKey:AISQKBVYHURRMU-UHFFFAOYSA-N
ID: 77240
SMILES:CC1(C)Oc2c(ccc(CCOC)c2)-c2c1cccc2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 268.356
CB1 binding score: -15.101
InChIKey:QHPFORUSSZFMIN-UHFFFAOYSA-N
ID: 77241
SMILES:C1C(C)(C)Oc2c(c(O)cc(CCCCC)c2)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -19.442
InChIKey:FRBSLGKYEBNHLH-UHFFFAOYSA-N
ID: 77242
SMILES:C(CCC)c1cc(O)c(C2C(C(C)C)CCC(C)=C2)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.459
CB1 binding score: -17.81
InChIKey:KVDBNLOKWYLSLD-UHFFFAOYSA-N
ID: 77243
SMILES:C(c1cc2c(c(O)c1)C1C(C(C)(C)O2)CC(C(=C)C)C2OC(=O)C(=C1)O2)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.51
CB1 binding score: -15.625
InChIKey:DNZIFLMJXSKEGZ-UHFFFAOYSA-N
ID: 77244
SMILES:C1C(=O)C(C(C)C)C2(Oc3c(c(O)cc(CC)c3)C2)C(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -17.434
InChIKey:UVCAFFHAENDCKD-UHFFFAOYSA-N
ID: 77245
SMILES:C1(O)C2C(C(C)(C)Oc3cc(CCC)cc(O)c32)C2C(=O)C13C(C(C)C2)C1OC(=O)C(=C)C1C(OC(=O)C)CC3(OC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cannabinoids;Guaiane sesquiterpenoids
MW: 596.717
CB1 binding score: -15.707
InChIKey:DQRJXYAZMULFTP-UHFFFAOYSA-N
ID: 77246
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(O)(CO)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -16.211
InChIKey:IFVIOJVZRCYUQV-UHFFFAOYSA-N
ID: 77247
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C=C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -20.081
InChIKey:XLSYFQOJMWXOCT-UHFFFAOYSA-N
ID: 77248
SMILES:Oc1c2c(c(OC)c(CC=C(CCC=C(C)C)C)c1)OC(C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.183
InChIKey:DFTUXTXJVMKRSD-UHFFFAOYSA-N
ID: 77249
SMILES:CC1(C)C2C(=O)Oc3c(c(O)cc(CCCCC)c3)C2(C)C(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -12.466
InChIKey:CFXDABSBXDVLKW-UHFFFAOYSA-N
ID: 77250
SMILES:C12(C)C3(C(C=C(C)CCC1OC(C)=O)OC(=O)C3C)Oc1cc(CCCCC)cc(OC)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.579
CB1 binding score: -15.477
InChIKey:NSHKPINOIIWXKF-UHFFFAOYSA-N
ID: 77251
SMILES:C1(C)(C)C2CC=C(C)CC2c2c(cc(CCCCC)c(C=O)c2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.059
InChIKey:IVRCBDVTRVUPTL-UHFFFAOYSA-N
ID: 77252
SMILES:C(=O)C1=CC2C(C(C)(C)Oc3c(C(C(C)C)=C)c(O)c(C=O)c(O)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.445
CB1 binding score: -16.543
InChIKey:SGGFVLZEUWTKTG-UHFFFAOYSA-N
ID: 77253
SMILES:CCC(CCCC)C(C(C)=C)CCC(C)=CCc1c(O)c(C)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.566
CB1 binding score: -14.956
InChIKey:IOWCHBSBQMAQRZ-UHFFFAOYSA-N
ID: 77254
SMILES:c1c(O)cc2c(c1O)C1C(C(C)(C)O2)CC(=O)C(C)=C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.315
CB1 binding score: -14.217
InChIKey:BLDSIPFKWYUCRR-UHFFFAOYSA-N
ID: 77255
SMILES:C1(C(C)C)C(c2c(O)cc(CCCCC)cc2O)CC(C)=CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.371
InChIKey:GSRXDBNJPHXNRM-UHFFFAOYSA-N
ID: 77256
SMILES:CC12CCCC(C)(C)C1C(O)c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.96
InChIKey:DDIVQORSYYKRDX-UHFFFAOYSA-N
ID: 77257
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 77258
SMILES:c1c(O)ccc2c1-c1c(O)cc(CCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.382
CB1 binding score: -16.558
InChIKey:LXHNHLATDAGGKO-UHFFFAOYSA-N
ID: 77259
SMILES:C(C)Cc1cc(O)c2c(c1)OC(C)(C)C1OC(=O)C(CCO)C1C=C2CO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.449
CB1 binding score: -16.077
InChIKey:FRESDZBEQJJQEI-UHFFFAOYSA-N