ID: 41581
SMILES:c12c(c(O)cc(CCCCC)c1)C=CC(CCC=C(C)C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 41582
SMILES:CC(=CC1C(=O)C(CO)=CC1c1c(O)c(C(=O)O)c(CCCCC)cc1O)C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.498
CB1 binding score: -14.622
InChIKey:XRRVDIJIGURMNP-UHFFFAOYSA-N
ID: 41583
SMILES:C1=C(C)CCC2c3c(cc(CCCCC)cc3O)OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.096
InChIKey:OPOIPENSMKDQLW-UHFFFAOYSA-N
ID: 41584
SMILES:O=C(C)Oc1ccc(O)c(CCC(OCCCCCCC)(C)C2CCC(C)=CC2)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -18.687
InChIKey:WSIZWERIULGGLT-UHFFFAOYSA-N
ID: 41585
SMILES:C12(C)C(O)(C(C)(C)CCC1)c1c(cc(CCCCC)c(C(O)=O)c1O)OC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -16.443
InChIKey:UHAVJBLRZNBTAW-UHFFFAOYSA-N
ID: 41586
SMILES:C(Cc1c2c(c(O)c(OC)c1)C=CC(C)(C)O2)(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -14.959
InChIKey:UUOANSPHEISPPE-UHFFFAOYSA-N
ID: 41587
SMILES:C(=C)(C)C1CCC(O)(C)C2Oc3c(c(O)cc(C)c3)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -16.646
InChIKey:JUEQMXVOZPWLKJ-UHFFFAOYSA-N
ID: 41588
SMILES:CCCCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 41589
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 41590
SMILES:CC1=CCC2=C(C(C)(C)Oc3c2c(O)cc(C)c3)CC1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -14.42
InChIKey:RCHQSAHYHBNZKC-UHFFFAOYSA-N
ID: 41591
SMILES:C(CC(c1c(O)cc2c(c1O)C1C(C(C)(C)O2)CC=C(C)C1)=C)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.438
InChIKey:SJQFYVVMFXRRIQ-UHFFFAOYSA-N
ID: 41592
SMILES:c1(OC)c(O)c2c(c(CCC(C(C)(OC)C)O)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.547
CB1 binding score: -15.12
InChIKey:QRVAENRCRWDICG-UHFFFAOYSA-N
ID: 41593
SMILES:C(c1cc2c(c(O)c1)C1C(C(C)(C)O2)CC=C(C(OC)=O)C1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -18.088
InChIKey:OUPMBZSEHHTPAE-UHFFFAOYSA-N
ID: 41594
SMILES:CC(C)CC(=O)C1CC(C(=C)C)C(c2c(O)cc(CCCCC)cc2O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -15.324
InChIKey:SJVHTVDDPFCKJJ-UHFFFAOYSA-N
ID: 41595
SMILES:C12C(C)CCC1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -19.029
InChIKey:HCVJHHUJBXZYBI-UHFFFAOYSA-N
ID: 41596
SMILES:C(CC1(C)Oc2c(c(O)cc(CCCCC)c2)C(O)C1O)C=C(C)CO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.482
CB1 binding score: -17.311
InChIKey:MAXUKEUJMOYDOP-UHFFFAOYSA-N
ID: 41597
SMILES:C(CC=C(C)C)C1(C)Oc2cc(CCC)cc(O)c2C(=O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -16.427
InChIKey:UICJWNGMMYLYIP-UHFFFAOYSA-N
ID: 41598
SMILES:C(CCCc1ccc(O)c(C2(C)CCCC(C)(C)O2)c1)CC1=CCC(C)CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -12.14
InChIKey:QEZPLXNOYLMVSR-UHFFFAOYSA-N
ID: 41599
SMILES:CC(C(c1c2c(c(=O)cc(CCCC)c1O)OC(C)(C)C1C2C=C(C)CC1)(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -18.517
InChIKey:RAYHCJJXWOLCGQ-UHFFFAOYSA-N
ID: 41600
SMILES:C1C2C(C)(C)Oc3c(cccc3)C2C=C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -18.438
InChIKey:CBEWCUWSPDDHMI-UHFFFAOYSA-N
ID: 41601
SMILES:C(C)(=CCCC1(C)Oc2cc(CCCCC)c(O)c(O)c2CC1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -15.706
InChIKey:GEUHDJTXTJLBGV-UHFFFAOYSA-N