ID: 35428
SMILES:C1CC(OC(C)=O)C(C)(C)C2C1c1c(cc(CCCCC)cc1OC(=O)C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -17.527
InChIKey:DBVLRUCLFAHUDZ-UHFFFAOYSA-N
ID: 35429
SMILES:c1(O)cc(CCCCC)c(O)c2c1C1C=C(CO)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.778
InChIKey:XZZRIGWRTMXFNI-UHFFFAOYSA-N
ID: 35430
SMILES:c1c(OC(C)=O)c(CCCC)cc2c1OC(C)(C)C(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.375
CB1 binding score: -14.991
InChIKey:PIMHOWABEFESJC-UHFFFAOYSA-N
ID: 35431
SMILES:C(=O)C1=C(C)CC(C)(C)CC=C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -11.585
InChIKey:LPPBNHJKQWDMFG-UHFFFAOYSA-N
ID: 35432
SMILES:C1C(C(C)=C)C(c2c(O)cc(CCCCCCC)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -18.188
InChIKey:GGHRHCGOMWNLCE-UHFFFAOYSA-N
ID: 35433
SMILES:c1(O)c(CCCCCC)cc(O)c2c1OC(C)(CCC=C(C)C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -15.855
InChIKey:YUBCAOZLMYWRFJ-UHFFFAOYSA-N
ID: 35434
SMILES:c1(C(=O)c2ccccc2)c(CCCCC)cc2c(c1OC)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.604
CB1 binding score: -15.506
InChIKey:XTIBLRDJAPDVLK-UHFFFAOYSA-N
ID: 35435
SMILES:C1C(CCC=C(C)C)(C)C2(c3c(cc(CCCCC)cc3O)OC2(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -13.513
InChIKey:SYZLSJVUZPRWGT-UHFFFAOYSA-N
ID: 35436
SMILES:CC1=CC2c3c(O)cc(C)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 35437
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1CCC(C)(C=CCC(C)C2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -15.519
InChIKey:JTIPBYLNUVZCEM-UHFFFAOYSA-N
ID: 35438
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 35439
SMILES:C1(CCC=C(CO)C)(C)Oc2cc(CCCCC)cc(O)c2C(=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -17.603
InChIKey:HFUWPJSBSVBTAO-UHFFFAOYSA-N
ID: 35440
SMILES:C1c2c(O)cc(CCCCC)cc2OC(C)(C)C2CCC(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.026
InChIKey:UWJTXRBBWOXUPZ-UHFFFAOYSA-N
ID: 35441
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 35442
SMILES:C(C(=O)O)=Cc1c(O)c2c(cc1C)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.408
CB1 binding score: -14.814
InChIKey:KYTSDXUUEXALHG-UHFFFAOYSA-N
ID: 35443
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1=C2C(OC(=O)C)C(C)=CC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.472
CB1 binding score: -14.439
InChIKey:PBLYSDIDANHJRH-UHFFFAOYSA-N
ID: 35444
SMILES:CCCCCc1c(O)ccc2c1C1C(C(C)(C)O2)CCC(C=O)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -14.041
InChIKey:ANNPSWQSJNROAS-UHFFFAOYSA-N
ID: 35445
SMILES:C1(C)(C)Oc2c(c(O)cc(C)c2)C2CC(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -18.804
InChIKey:NJEVKSYKELTXNY-UHFFFAOYSA-N
ID: 35446
SMILES:CC(C)=CCCC(C)=CCC(=O)C(=CCc1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -17.195
InChIKey:BIDAIXNMSYPRFX-UHFFFAOYSA-N
ID: 35447
SMILES:C(CCCC)c1cc2c(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: 35448
SMILES:c1(O)cc(CCCCC)cc2c1C1C(C(C)(CCC=C(C)C)O2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.828
InChIKey:VWVYPBSOQKGBDL-UHFFFAOYSA-N