ID: 44731
SMILES:C1(C)=C2CCC(C)C3(Oc4c(c(O)cc(CCCCC)c4)C3)C2C(C)(C)C(O)C(C=C(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.706
CB1 binding score: -15.379
InChIKey:QFXQKVSZUZKLKL-UHFFFAOYSA-N
ID: 44732
SMILES:C1(CCC=C(C)C)(C)Oc2cc(CC=C)cc(O)c2C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -14.679
InChIKey:AJVQSTOSQYIPRE-UHFFFAOYSA-N
ID: 44733
SMILES:C1(=C)C2CCC(C)=CC3C(c4c(O)cc(CCC)cc4OC3(C)C)C=C(C)C2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.555
CB1 binding score: -14.775
InChIKey:RCUYUFAXIMJOBE-UHFFFAOYSA-N
ID: 44734
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 44735
SMILES:C(C)(=CCCC1(C)Oc2cc(CCC)cc(O)c2C=C1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -18.334
InChIKey:AAXZFUQLLRMVOG-UHFFFAOYSA-N
ID: 44736
SMILES:O=C(Oc1cc2c(cc1CCCCC)OC(C)(C)C(O)C2)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.402
CB1 binding score: -14.667
InChIKey:VMIWOGPVZMQQMO-UHFFFAOYSA-N
ID: 44737
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)c1c-2cc(C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 44738
SMILES:CCC(=O)C(C(C)=O)C(=O)OC1C=C2C(c3c(cc(CCCCC)cc3O)OC2(C)C)C(OC(=O)C)C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 528.642
CB1 binding score: -14.683
InChIKey:WXQPCXZJFMBNHA-UHFFFAOYSA-N
ID: 44739
SMILES:Oc1cc(CC)c(C=O)c(O)c1C1C=C(C)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -17.123
InChIKey:HXGWGRYTILONJF-UHFFFAOYSA-N
ID: 44740
SMILES:c12c(cc(CO)c(CCC)c1O)OC(CCC=C(C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -15.327
InChIKey:OFSNNNBVSCRUTO-UHFFFAOYSA-N
ID: 44741
SMILES:C12c3c(c(O)cc(CCCCC)c3)OC(C1=C)CC(CC=C(C)C)C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -15.507
InChIKey:JOMAOQVRFQVVRG-UHFFFAOYSA-N
ID: 44742
SMILES:OC(C)(C=CC1Oc2c(c(O)cc3c2COC(C)(C)C3O)CC=C1C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -13.74
InChIKey:IMBXKFVGZVBSNG-UHFFFAOYSA-N
ID: 44743
SMILES:c12c(cc(CCCCC)cc1O)OC1(C3(C)CCC(C(=C)C)C(CCC(=O)C)(C)CC3C1)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.679
CB1 binding score: -15.79
InChIKey:LLDSZFLSZLZWEK-UHFFFAOYSA-N
ID: 44744
SMILES:CC1(C)C2C(c3c(O)cc(CCCCC)cc3O2)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -13.794
InChIKey:XTGXMHPLFOSWPJ-UHFFFAOYSA-N
ID: 44745
SMILES:CC(=O)Oc1c(CC=C(C)C)ccc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -16.798
InChIKey:YMHWDGOIUGZRCX-UHFFFAOYSA-N
ID: 44746
SMILES:c1c(C)c(CCC)c2c(c1)C1CC(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.459
CB1 binding score: -15.355
InChIKey:JIDUICUOTZLOPK-UHFFFAOYSA-N
ID: 44747
SMILES:c1(O)c2ccc(c1)OC(C)(C)C1C2C=C(COC(=O)C(CC)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -14.23
InChIKey:CLHIGXOITYJDSM-UHFFFAOYSA-N
ID: 44748
SMILES:CC1(C)C(C=C(C)C)OC(c2c(O)cc(CCCCCO)cc2O)CC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.537
CB1 binding score: -16.178
InChIKey:JMBGRIWPFDGZKJ-UHFFFAOYSA-N
ID: 44749
SMILES:C(CCCC)Cc1cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 44750
SMILES:c1(O)c2c(cc(C(c3ccc(OC)cc3)CC)c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.539
CB1 binding score: -14.796
InChIKey:UOYPXVXIWZDVOK-UHFFFAOYSA-N
ID: 44751
SMILES:C1C(C(C)=C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N