ID: 88012
SMILES:Oc1c2c(cc(O)c1CCCCCC)OC(C)(C)C1C2CC(CO)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -12.943
InChIKey:OGDCVUNYXMRTQE-UHFFFAOYSA-N
ID: 88013
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C(CCC(COC(C=CC)=O)C1O)(C)C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: Not available
InChIKey:KUBJLIJJIOHPHX-UHFFFAOYSA-N
ID: 88014
SMILES:C1=C(C)CCC(C(C)=C)C1c1c(O)cc(O)cc1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.677
InChIKey:YWEZXUNAYVCODW-UHFFFAOYSA-N
ID: 88015
SMILES:C(C=Cc1c(O)c2c3c(c1)OC(C)(C)C1C3C(C2=O)C(C)(O)CC1)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -13.662
InChIKey:KJQTYKAOOVSMOX-UHFFFAOYSA-N
ID: 88016
SMILES:C1(c2c(OC)cc(CCCCC)cc2)C=C(C)CCC1C(C)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -16.747
InChIKey:MSKIKBIDOQFGNE-UHFFFAOYSA-N
ID: 88017
SMILES:C1CC2=C(c3c(cc(CCCCC)cc3O)O1)C(C)(C)OC2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -15.184
InChIKey:YJGQWEBYDUWMKE-UHFFFAOYSA-N
ID: 88018
SMILES:C1(C)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 88019
SMILES:C12C(c3c(cc(CCCCC)cc3O)OC1(C)CCC=C(C)C)C(C)CC(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -15.254
InChIKey:FIWSVOWPZUVOFY-UHFFFAOYSA-N
ID: 88020
SMILES:C(C12C(O)C(O)C(CO)=C3CC(C)(C)C3CC1)Oc1c(c(O)cc(CCCCC)c1)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.557
CB1 binding score: -15.261
InChIKey:KYIPDRZBIKLQPC-UHFFFAOYSA-N
ID: 88021
SMILES:c1(CCCOC)c(O)cc2c(c1)OC(C)(C)C1C2CC(C)(O)C2OC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.439
CB1 binding score: -16.589
InChIKey:LTHUHMALBUNSCH-UHFFFAOYSA-N
ID: 88022
SMILES:C(CCc1cc(O)c(CC=C(C)C)c(O)c1)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -18.498
InChIKey:SSYFVGGKLHQDPS-UHFFFAOYSA-N
ID: 88023
SMILES:CCCCCc1cc2c(c(OC(C)=O)c1)OC1(CCC3C(C(CC=C(C)C)O)(C)C1C3)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: -14.966
InChIKey:MTNHSNRCYMGXKP-UHFFFAOYSA-N
ID: 88024
SMILES:C1=C(C)CC(OC(C)=O)C=C(C)C2C(C2)c2c(O)cc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -13.666
InChIKey:BFEMVFGFRYOCAZ-UHFFFAOYSA-N
ID: 88025
SMILES:c1(-c2ccc(Br)cc2)c(CCCCC)cc2c(c1)OC(C)(C)C1CC=C(C(O)=O)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 483.446
CB1 binding score: -15.229
InChIKey:YYKGGCQPEHRPDV-UHFFFAOYSA-N
ID: 88026
SMILES:C1(C)=CC2c3c(cc(CCCCC)c(C(=O)O)c3O)OC(C)(C)C2CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -18.46
InChIKey:VEJFACHEOKRKRF-UHFFFAOYSA-N
ID: 88027
SMILES:C(c1c(=O)c2c(ccc1)OC(C)(C)C1CCC(C)(O)CC21)(C(C)C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.112
InChIKey:MILYLQASTWUESN-UHFFFAOYSA-N
ID: 88028
SMILES:O=C1C(C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.322
CB1 binding score: -19.037
InChIKey:WOUJHLUSTPDGBC-UHFFFAOYSA-N
ID: 88029
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2=C(CC1C1(C)CCC3C1C3(C)C)OC1C2C(=C)C(=O)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.602
CB1 binding score: -14.737
InChIKey:WRGCTWHKXCZRRM-UHFFFAOYSA-N
ID: 88030
SMILES:c1(O)c2c(cc(CCC)c1)OC(C)(C)C1CC=C(COC)C(=O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -13.992
InChIKey:BRTHTOWALUEJDU-UHFFFAOYSA-N
ID: 88031
SMILES:O(C)c1cc2c(cc1)OC(C)(C)C1CC(O)C(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -15.418
InChIKey:XHRLIFMWNNDENL-UHFFFAOYSA-N
ID: 88032
SMILES:C1=CC(C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -20.081
InChIKey:XLSYFQOJMWXOCT-UHFFFAOYSA-N