ID: 31438
SMILES:C(CCC=C(C)CCC=C(CC)C)(C)=CCc1c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 370.577
CB1 binding score: -14.874
InChIKey:MKDOQNWIURUKBW-UHFFFAOYSA-N
ID: 31439
SMILES:C(c1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)C1)(OC)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -17.613
InChIKey:FPLFPJCOLKWIFT-UHFFFAOYSA-N
ID: 31440
SMILES:c1(O)cc(CCCC)cc2c1C1C(C(C)(C)O2)C=CC(C)(CC2C(C(=C)C)CCC3(C)C1O3)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.662
CB1 binding score: -14.428
InChIKey:JXXNHIPAWQUCFX-UHFFFAOYSA-N
ID: 31441
SMILES:C1(C)=CC2c3c(O)cc(CCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 31442
SMILES:C(C)(C)=CCc1c(O)c(C(O)=O)c(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.375
CB1 binding score: -19.394
InChIKey:IQDBYPKRWVDTCI-UHFFFAOYSA-N
ID: 31443
SMILES:C=C(C12Oc3c(c(OC)cc(CCCCC)c3)C(CCC=C(C)C)(C)C1CC(OC(=O)C)=C(C)C2=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 508.699
CB1 binding score: -16.758
InChIKey:GLAYBUTXAUMNLR-UHFFFAOYSA-N
ID: 31444
SMILES:c1c(CCCCC)cc(CC=C(C)CC(=O)C=C(C)C)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.039
InChIKey:GRCYVVDSNVKDMK-UHFFFAOYSA-N
ID: 31445
SMILES:C1(C)C2C(C(C(C)C=O)CC1)c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.716
InChIKey:IYTDAOWTIIXGPB-UHFFFAOYSA-N
ID: 31446
SMILES:C1C=C(C)C(=O)CC2C(C)(C)Oc3c(c(O)cc(C)c3)CC2C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -16.522
InChIKey:CENSGPXMKDRJOY-UHFFFAOYSA-N
ID: 31447
SMILES:O(c1cc(C)cc(O)c1C1C=C(C)CCC1C(C)=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -17.99
InChIKey:JIAMDLHQCKSETM-UHFFFAOYSA-N
ID: 31448
SMILES:C1(C)=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)c(C(=O)O)c(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.351
InChIKey:UCONUSSAWGCZMV-UHFFFAOYSA-N
ID: 31449
SMILES:c1(CCCCC)cc2c(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: 31450
SMILES:COc1c2c(cc(CCCCC)c1)OC(C)(C)C1=C2C(=O)C(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -14.873
InChIKey:TVBIJZHCFSZEGU-UHFFFAOYSA-N
ID: 31451
SMILES:C1=CC2C(C)C3(C)C1(OC2=O)c1c(cc(CCCCC)cc1O)OC3(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -13.136
InChIKey:TWRPUOFCMLCLBJ-UHFFFAOYSA-N
ID: 31452
SMILES:C(CCC)c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C(O)=O)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -16.975
InChIKey:DHXIVHTVASKKFZ-UHFFFAOYSA-N
ID: 31453
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(CCC=C(C)CCC=C(C)C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -19.601
InChIKey:JXEWSPILIYHMCP-UHFFFAOYSA-N
ID: 31454
SMILES:c1(O)cc(CCCCC)cc2c1C1C=C(C(=O)OC)CC(=O)C(O)C(C)(C2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.46
CB1 binding score: -16.502
InChIKey:CQYCBAUEOPIMNU-UHFFFAOYSA-N
ID: 31455
SMILES:C1(O)(C)CC2C(CC1)C(C)(C)Oc1cc(CCCCC)c(C(OC)=O)c(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -15.562
InChIKey:ZCNKZNNYGJDFJM-UHFFFAOYSA-N
ID: 31456
SMILES:c12c(ccc(C)c1)C(C)(C)Oc1c-2cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -17.71
InChIKey:KNMCRTPYWNCWFQ-UHFFFAOYSA-N
ID: 31457
SMILES:C12(O)C3C(C)(CCC1(C)CC(=O)CCC2=O)Oc1c(c(O)cc(CCC)c1)C3O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.487
CB1 binding score: -11.74
InChIKey:CWMHXRODHZUPGX-UHFFFAOYSA-N
ID: 31458
SMILES:CC(CCCc1cc2c(c(O)c1)C1C(CCC(COC(C)=O)=C1)C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -12.65
InChIKey:LSNPXJOBJHAPRA-UHFFFAOYSA-N