ID: 118672
SMILES:C1(=O)c2c(CCCC)ccc(c2)CC(C)(C)C2C(CCCO)C(=C(C)C)CCC2(C)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.641
CB1 binding score: -14.16
InChIKey:KUIIKTJSEYXZHA-UHFFFAOYSA-N
ID: 118673
SMILES:O1C(C)(C)C2CCC(C)=CC2c2c(O)cc(CCCCC)c(C(=O)C=Cc3ccccc3)c21
Pathway: Polyketides;Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids;Flavonoids
Class: Cannabinoids;Chalcones
MW: 444.615
CB1 binding score: -14.174
InChIKey:YSYBEIMQLFEKNZ-UHFFFAOYSA-N
ID: 118674
SMILES:CC(=CCCC(C)=CCCC(C)=CCc1c(O)cc(CC(O)=O)c(O)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Merosesquiterpenoids;Tetraketide meroterpenoids
MW: 372.505
CB1 binding score: -18.306
InChIKey:BDRGSNYWOXCBFU-UHFFFAOYSA-N
ID: 118675
SMILES:c1(O)c(C(=O)OC)cc(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -17.271
InChIKey:QQPTXDFQVDFRJY-UHFFFAOYSA-N
ID: 118676
SMILES:C(Oc1cc(CCC)cc(O)c1CCCC)C1=CCC2CC1C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Monoterpenoids
Class: Cannabinoids;Pinane monoterpenoids
MW: 342.523
CB1 binding score: -14.502
InChIKey:ODIOEMLFKHARBL-UHFFFAOYSA-N
ID: 118677
SMILES:C1CC(Oc2c(CCCCC)cc3c(c2)OC(C)(C)C(O)C3)OC1CO
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.482
CB1 binding score: -12.766
InChIKey:KLMHAHQICGABBR-UHFFFAOYSA-N
ID: 118678
SMILES:C(C)(C)C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 118679
SMILES:CC(C)C1(OC)CCC(O)(C)C2Oc3cc(CCCCC)cc(O)c3C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -16.868
InChIKey:RIABTKDQQSPRRT-UHFFFAOYSA-N
ID: 118680
SMILES:CC1=CC(O)CC2(C)OC2Cc2c(OC)cc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.275
InChIKey:ARZCURPNIOGLKQ-UHFFFAOYSA-N
ID: 118681
SMILES:C(CC1(C)C=Cc2c(O)cc(CCCCC)cc2O1)C(C(C)=C)O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.337
InChIKey:IDJFUDPWCZNLTI-UHFFFAOYSA-N
ID: 118682
SMILES:Clc1c2c(c(O)c(C=O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.789
CB1 binding score: -11.705
InChIKey:NAUKCKNBCJEVAN-UHFFFAOYSA-N
ID: 118683
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2CC(C)=CCC2C(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.943
InChIKey:LKFLWBZTDVUDPA-UHFFFAOYSA-N
ID: 118684
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21)C(C)=CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -15.519
InChIKey:FNDNCDWJHFGXGR-UHFFFAOYSA-N
ID: 118685
SMILES:CC1(C)Oc2c(c(OC)c(O)cc2CCCCC)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.392
CB1 binding score: -15.704
InChIKey:QIIXFJLBCLBSLI-UHFFFAOYSA-N
ID: 118686
SMILES:CC1(O)C=CC(C(C)C)Cc2c(O)cc(CCCN)cc2O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 305.418
CB1 binding score: -13.311
InChIKey:BYMNZYCNWRRBKD-UHFFFAOYSA-N
ID: 118687
SMILES:C(C(C1C2(Cc3c(O)cc(C(O)=O)c(CCCCC)c3OC2)CC1)=C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.434
CB1 binding score: -13.673
InChIKey:SZCHHVSHCXGIDO-UHFFFAOYSA-N
ID: 118688
SMILES:C1(c2cc(O)c(CC=C(CCC=C(C)C)C)c(OC)c2)C=C(C)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.599
CB1 binding score: -13.816
InChIKey:FGVXIVZBRSSYPR-UHFFFAOYSA-N
ID: 118689
SMILES:CC(=CCc1c(OC)cc(CCC)cc1OC)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.432
InChIKey:SGCYLRZOKBHTMC-UHFFFAOYSA-N
ID: 118690
SMILES:C1Oc2c(c(O)cc(CCCCC)c2)C1=C(CC=C(CCC=C(C)C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -15.041
InChIKey:WCOCSDVMTBRLAK-UHFFFAOYSA-N
ID: 118691
SMILES:C1(C(=C)C)CCC(C)=CC1c1c(O)cc(CC=C(C)CCC=C(C)C)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.573
CB1 binding score: -15.668
InChIKey:VDRLZBNTRRDTGV-UHFFFAOYSA-N
ID: 118692
SMILES:Oc1c(CC=C(CCC=C(C)C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N