ID: 44899
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)c1c2cc(C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -18.225
InChIKey:XUERFRQVGLONMR-UHFFFAOYSA-N
ID: 44900
SMILES:Oc1cc(CCCCC)cc2c1-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 44901
SMILES:c1(CCCC)cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.175
InChIKey:RVWTXSLOGRTPEH-UHFFFAOYSA-N
ID: 44902
SMILES:C(Cc1cc(C2C=C(C)CCC2C(=C)C)c(O)c(CC=C(C)CCC=C(C)C)c1O)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.718
CB1 binding score: -14.309
InChIKey:JOVGIXCUYRUCGH-UHFFFAOYSA-N
ID: 44903
SMILES:C(O)C=Cc1cc(OC)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -17.144
InChIKey:KOYIZWZMCRSBIX-UHFFFAOYSA-N
ID: 44904
SMILES:C1=C(C)CC2C(C(C)(C)Oc3cc(CCc4ccccc4)cc(O)c32)C1
Pathway: Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids;Stilbenoids
Class: Cannabinoids;Monomeric stilbenes
MW: 348.486
CB1 binding score: -17.817
InChIKey:AAVGZFGYDPFYEH-UHFFFAOYSA-N
ID: 44905
SMILES:OC(c1c(O)c2c(cc1C)OC(C)(C)C1CCC(C)=CC21)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -19.064
InChIKey:BWFHYGJGKLAXKO-UHFFFAOYSA-N
ID: 44906
SMILES:Oc1cc(CCCCC)cc2c1C1C(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: 44907
SMILES:CC1(C)C2CCC(C)=CC2c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 44908
SMILES:C(CC1(C)Oc2c(c(O)cc(CCCCC)c2)CC1C(O)(C)C=CC=C(C)C)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.668
CB1 binding score: -14.263
InChIKey:CQOBDVPHWIYIOZ-UHFFFAOYSA-N
ID: 44909
SMILES:C(CCc1cc(O)c2c(c1)C1C=C(C)CCC1C(C)(C)O2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.438
InChIKey:NKPBIUKTNLMNFS-UHFFFAOYSA-N
ID: 44910
SMILES:o1c(CCCCC)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -16.496
InChIKey:YFDZZYBMGPHHKQ-UHFFFAOYSA-N
ID: 44911
SMILES:C(CCC)c1ccc(O)c2c1OC(C)(C)C1CCC(C(=O)OC)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.544
InChIKey:BGRJSKVDTUFTTN-UHFFFAOYSA-N
ID: 44912
SMILES:C(C(=CCCC(=CCc1c(O)cc(CCC)cc1O)C)C)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 356.55
CB1 binding score: -18.934
InChIKey:LDZQKZLPWVBJOB-UHFFFAOYSA-N
ID: 44913
SMILES:C1(C)=CC(c2c(O)cc(CCCCCO)cc2O)C2CC(C)CCC2C2(C)C1C(=O)C(=C(O)CC)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 498.66
CB1 binding score: -16.468
InChIKey:KPEGRFUCCIBIEE-UHFFFAOYSA-N
ID: 44914
SMILES:C1(O)CC(C)=CC2C1C(C)(C)Oc1cc(C)c(O)cc12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 274.36
CB1 binding score: -16.698
InChIKey:IWDTYONXAWFHQB-UHFFFAOYSA-N
ID: 44915
SMILES:C1Cc2c(c(OC)cc(C)c2)OC1(C)CC1OC(=O)C(CC)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -15.2
InChIKey:WNKPOTMLTQGMFQ-UHFFFAOYSA-N
ID: 44916
SMILES:C(CCCC)c1cc2c(c(O)c1)C1=C(C(C)(C)O2)CCC(O)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.269
InChIKey:SEZYEGYUECNXNK-UHFFFAOYSA-N
ID: 44917
SMILES:c1(C2C(C(C)=C)C(c3c(O)cc(CCCCC)cc3O)C(O)C2O)cc(O)ccc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.525
CB1 binding score: -13.477
InChIKey:FDEPJBOIZXEILD-UHFFFAOYSA-N
ID: 44918
SMILES:O1C(=O)CCC2C(=O)OC(C)(C)C2CC=C(C)CC=CC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -15.951
InChIKey:HSLOQOZPYLKJCU-UHFFFAOYSA-N
ID: 44919
SMILES:C1(C)(C2C(c3cc(CCCCC)ccc3O)Oc3c2c(=O)oc(C(C)=O)c3)C2C(C)(C)C(CC1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.629
CB1 binding score: -15.897
InChIKey:ZSWDQRAQUCFXIJ-UHFFFAOYSA-N