ID: 60460
SMILES:Clc1c(CCCCC)c(O)c2c(c1O)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.913
CB1 binding score: -17.144
InChIKey:RIWXRDZJKQBIDV-UHFFFAOYSA-N
ID: 60461
SMILES:C12Oc3c(c(O)cc(CCCCC)c3)C3C1(C)C(CO2)C(C(C)=C)CC3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -16.22
InChIKey:IJHNWSIMTFUFEG-UHFFFAOYSA-N
ID: 60462
SMILES:C1(C)C(O)C(=O)C2Cc3c(O)cc(C)cc3OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -15.702
InChIKey:KPGWMSIZVXDCHD-UHFFFAOYSA-N
ID: 60463
SMILES:c12c(c(O)cc(CCCc3ccc(OC)cc3)c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.539
CB1 binding score: -14.997
InChIKey:RMRNPNKGQDPCAU-UHFFFAOYSA-N
ID: 60464
SMILES:C(C=Cc1c2c(c(O)cc1C)OC(C)(C)C1CCC(C)=CC21)(=O)C(CCCCCCCC)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.635
CB1 binding score: -17.571
InChIKey:IQLGBMUJYJQPIF-UHFFFAOYSA-N
ID: 60465
SMILES:CC1(C)C2CC=C(C)CC2c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 60466
SMILES:Oc1cc(CCCCC)cc2c1C1C=C(C)C(O)C(O)C1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -17.469
InChIKey:QVWHLGXVMHTVTO-UHFFFAOYSA-N
ID: 60467
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -19.729
InChIKey:GIIVGKMZIUKMMN-UHFFFAOYSA-N
ID: 60468
SMILES:C(Cc1cc(O)c(CC=C(C)C)c(O)c1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -18.498
InChIKey:SSYFVGGKLHQDPS-UHFFFAOYSA-N
ID: 60469
SMILES:c1(CCCC)cc2c(c(O)c1)C1(CC=C(CCC=C(C)C)C)C(C(O)(C)O2)Oc2c1c(O)cc(O)c2C=CC(C)(C)O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 578.746
CB1 binding score: -15.224
InChIKey:CWQHZNHYNOQMRM-UHFFFAOYSA-N
ID: 60470
SMILES:O(C(C)=O)C1C(C)=CC2C(C1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -17.976
InChIKey:PGFFULLVBBCSMB-UHFFFAOYSA-N
ID: 60471
SMILES:c1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.189
InChIKey:AIOSXAOKGBOYPS-UHFFFAOYSA-N
ID: 60472
SMILES:C1(C)(C)C(Cc2c(OC)c(CC=C(C)C)c(CCCCC)cc2O)C2(C)CCC1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.63
CB1 binding score: -15.621
InChIKey:VOCZFZOVQJMBQB-UHFFFAOYSA-N
ID: 60473
SMILES:C12=CC(CCC(C)C)=C(C)C3CC(CCC13)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.448
CB1 binding score: -14.642
InChIKey:AFJHDCMSESTVKR-UHFFFAOYSA-N
ID: 60474
SMILES:C1(OC)C(C)C23C(C)(C4C(C(C)CC4)C2O1)Oc1c3c(OC)cc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -16.052
InChIKey:IPRMEQWPXMRMMU-UHFFFAOYSA-N
ID: 60475
SMILES:C12C3(C)C(=O)C4=C(c5ccccc5)OC(C)(C)C3CC1C(C)(C)OC4=C(C(CC(C)C)=O)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.586
CB1 binding score: -14.66
InChIKey:OZGOPRDCUSGQTG-UHFFFAOYSA-N
ID: 60476
SMILES:CC(=CCc1c(O)cc(CCc2ccc(O)cc2)cc1O)CCC=C(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.62
CB1 binding score: -19.427
InChIKey:VVBVATXKSUVSTB-UHFFFAOYSA-N
ID: 60477
SMILES:Oc1c(Cc2cc3c(c(OC)c2)CC2C(C)(C=CC(O)C2(C)C)O3)cc(O)c2c1C1CC(C)(O)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 564.719
CB1 binding score: -13.318
InChIKey:XKVQFUPMOQJAAH-UHFFFAOYSA-N
ID: 60478
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 60479
SMILES:C12C(C)(CCC1C(O)(C)C)Oc1c(ccc(CCCCC)c1O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -15.453
InChIKey:PILQHPJETWYCPT-UHFFFAOYSA-N
ID: 60480
SMILES:CC(CCC=C(CCC(C(=C)C)O)C)=CCc1c(O)c(C(O)=O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 444.612
CB1 binding score: -16.923
InChIKey:BXQHFNVALYPYHU-UHFFFAOYSA-N