ID: 92296
SMILES:CCC(=O)c1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -18.657
InChIKey:FDLOCOCZVCOHMB-UHFFFAOYSA-N
ID: 92297
SMILES:CC(CC1=CC(C(C)=C)C(c2c(O)cc(CCCCC)cc2O)CC(C)=C1)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -15.293
InChIKey:TUBPYGBMSVDXTF-UHFFFAOYSA-N
ID: 92298
SMILES:c1(CCCCC)cc(OCC=C(C)CC2OC(=O)C(=C)C2)cc(O)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.929
InChIKey:XWSYWXLSQBGCIO-UHFFFAOYSA-N
ID: 92299
SMILES:C(CN)Cc1cc(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 301.43
CB1 binding score: -15.82
InChIKey:BPZINJKCESLWBZ-UHFFFAOYSA-N
ID: 92300
SMILES:C(CCCC)c1cc(O)c(C2C=C(C)CCC2C(C)=C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.957
InChIKey:OANGEIYPAQYPQV-UHFFFAOYSA-N
ID: 92301
SMILES:c1(C(O)CCCCC)cc(O)c2c(c1)OC(C)(C)C1CC(=O)C(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.131
InChIKey:LTZHLQQBUNPSGN-UHFFFAOYSA-N
ID: 92302
SMILES:C1(C)(C)C2C(O)c3c(cc(CCCCC)cc3O)OC2(C)CC=C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.048
InChIKey:IAUFVLGDAYSJMQ-UHFFFAOYSA-N
ID: 92303
SMILES:C1C2C(C)(C)Oc3c(c(O)c(C=O)c(O)c3C=O)C(C)c3c(c(cc(CCCCC)c3O)O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.546
CB1 binding score: -15.085
InChIKey:ZYXMGEKOPFDSKG-UHFFFAOYSA-N
ID: 92304
SMILES:C1(C)C2(C)Oc3c(c(O)c(C(O)=O)c(CCCCC)c3)C2C2C(C)(O2)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -13.679
InChIKey:SMZGMSBDAMLFEO-UHFFFAOYSA-N
ID: 92305
SMILES:C(=O)(c1cc(CCCCC)c(CC=C(C)CCC=C(C)C)c(O)c1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.48
InChIKey:KCCAHVSNNJZSMD-UHFFFAOYSA-N
ID: 92306
SMILES:O1c2cc(CCCCC)cc(O)c2C2C(=C1C)C(C=C(C)C)CC2(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.653
CB1 binding score: -14.299
InChIKey:RYTFAHOZJIQRNS-UHFFFAOYSA-N
ID: 92307
SMILES:CCCCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 92308
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(c1c(O)cc(C)cc1)C(O)C2
Pathway: Polyketides;Shikimates and Phenylpropanoids
Superclass: Meroterpenoids;Flavonoids
Class: Cannabinoids;Flavan-3-ols
MW: 342.435
CB1 binding score: -14.227
InChIKey:HSBATVCBSITWAW-UHFFFAOYSA-N
ID: 92309
SMILES:O=c1c(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.069
InChIKey:UHOWGFRFPWIPRC-UHFFFAOYSA-N
ID: 92310
SMILES:C1=C(C)CCC2C(C)(C)Oc3cc(C(=O)C(C)C)c(O)c(C(C(C)C)=O)c3C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Phloroglucinols
Class: Cannabinoids;Prenylated,geranylated phloroglucinols
MW: 384.516
CB1 binding score: -16.837
InChIKey:WVVMLCIPVIPFQU-UHFFFAOYSA-N
ID: 92311
SMILES:c12c(c(CCCCC)cc(O)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.63
InChIKey:LAYHJCJKKWVWTP-UHFFFAOYSA-N
ID: 92312
SMILES:C1(c2c(O)cc(CCCCCC)cc2O)OC2C3CC(C(O)(COC)C(C2)C1)C31CCCC=C1CCCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 554.812
CB1 binding score: -15.574
InChIKey:PAEDLTVWGFLBAH-UHFFFAOYSA-N
ID: 92313
SMILES:COc1c(CCCCC)ccc2c1C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.524
InChIKey:SIMGPDAKFQAWDE-UHFFFAOYSA-N
ID: 92314
SMILES:CC1(C)C2C(CC(O)(C)CC2)c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 92315
SMILES:Oc1cc2c(cc1C)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.07
InChIKey:JAQQPODSAWTCBC-UHFFFAOYSA-N
ID: 92316
SMILES:c1(C(C=C(C)C)=O)cc(CCCCCC)cc2c1OC(C)(C)C1CCC(O)(C)C(CCC(C)=C2)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.733
CB1 binding score: -13.104
InChIKey:AEHZEPGJOROJRS-UHFFFAOYSA-N