ID: 72010
SMILES:C(CCc1cc(O)c(CC=C(CCC=C(C)C)C)cc1)(=O)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.143
InChIKey:QEKVOXFOINRURS-UHFFFAOYSA-N
ID: 72011
SMILES:c1(O)cc2c(cc1CCC(OCCO)COC)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -15.407
InChIKey:IRRPBJYODVYPIY-UHFFFAOYSA-N
ID: 72012
SMILES:C1(Cl)c2c(O)ccc3c2C2C(C(C)(C)O3)CC2(O)OC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.804
CB1 binding score: -16.683
InChIKey:OQPARZMXIQBFFR-UHFFFAOYSA-N
ID: 72013
SMILES:C1CC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2C1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.855
InChIKey:KBTNQOVTNZTJGJ-UHFFFAOYSA-N
ID: 72014
SMILES:C(=C(C)C)CCC1(C)Oc2c(c(O)cc(CCCCC)c2O)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.334
InChIKey:AGCCFGXZUUPBIN-UHFFFAOYSA-N
ID: 72015
SMILES:C1=C(C(=O)O)CCC2C3(C)CCCC(C)(C)C12Oc1c3c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -16.658
InChIKey:IFOCNIPALSBIOB-UHFFFAOYSA-N
ID: 72016
SMILES:C(CCC=C(C)C12CCC(C)=CC1c1c(cc(CCCCC)cc1O)O2)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.599
CB1 binding score: -16.514
InChIKey:CGCBLNGYDZYDEX-UHFFFAOYSA-N
ID: 72017
SMILES:Oc1cc(CCCC)cc2c1-c1cc(C)ccc1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.41
CB1 binding score: -19.327
InChIKey:GGVVJZIANMUEJO-UHFFFAOYSA-N
ID: 72018
SMILES:c12c(ccc(O)c1)OC(C)(C)C1CC=C(C)CC1C=C(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -14.168
InChIKey:FWUCNXBACGSJFP-UHFFFAOYSA-N
ID: 72019
SMILES:C1(C(=C)C)C(c2c(O)cc(CCCCC)cc2O)CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.129
InChIKey:ZTGXAWYVTLUPDT-UHFFFAOYSA-N
ID: 72020
SMILES:c1(CC(OC(c2ccccc2)CC)=O)c(C(OC(C(C)CC)=O)C(CC)C)cc(O)c2c1OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 590.801
CB1 binding score: -16.981
InChIKey:GELNPMUBIRDLHU-UHFFFAOYSA-N
ID: 72021
SMILES:CC(C)=CCCC(=CCc1c(O)cc(CCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N
ID: 72022
SMILES:Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(CO)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -18.328
InChIKey:IWHYDYORMMBLMI-UHFFFAOYSA-N
ID: 72023
SMILES:C(C)(=CCc1cc(O)c(CC(O)=O)cc1O)CCC=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Merosesquiterpenoids;Tetraketide meroterpenoids
MW: 372.505
CB1 binding score: -18.306
InChIKey:BDRGSNYWOXCBFU-UHFFFAOYSA-N
ID: 72024
SMILES:c12c(c3c(cc1O)OC(C)(C=CC=C(C)C)CC3)OC(C)(C)C1C2CC(C)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -15.456
InChIKey:GIPPTSGQDSHYKV-UHFFFAOYSA-N
ID: 72025
SMILES:C1(C)=CCCC(C)(O)C2C(C1)C(C)(C)Oc1c2cc(O)c(CC=C(CCC=C(C)C)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.651
CB1 binding score: -14.748
InChIKey:QIPSEEDXQYYHDJ-UHFFFAOYSA-N
ID: 72026
SMILES:C1(c2c(O)cc(CCCCC)cc2)C=C(C)CCC1(O)C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.134
InChIKey:CMALWUYNXYEHMS-UHFFFAOYSA-N
ID: 72027
SMILES:C1=C(C)C2C(COc3c(OC)cc(CCCCCCCC)cc3OC2O)CC1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -13.852
InChIKey:ZJGHEWHTJZMHAY-UHFFFAOYSA-N
ID: 72028
SMILES:C(Cc1cc(O)c2c(c1C(=O)C(C)CC)OC(C)(C)C1CCC(C)=CC21)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.641
CB1 binding score: -11.473
InChIKey:UQTUGIKWPNPLOD-UHFFFAOYSA-N
ID: 72029
SMILES:C(=CC(=C)CCC=C(C)C)CC(C)=CCc1cc(O)c(C)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -16.002
InChIKey:SWUARRVUKUFCPZ-UHFFFAOYSA-N
ID: 72030
SMILES:C1(OC)OC(C(OC(C)=O)CCC(C)=CCc2c(O)c(C)cc(O)c2)=CCCC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.53
CB1 binding score: -14.612
InChIKey:MFNOPZGMKIERDK-UHFFFAOYSA-N