ID: 89356
SMILES:C1=C2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)CCC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.727
InChIKey:YLTWYAXWDLZZCU-UHFFFAOYSA-N
ID: 89357
SMILES:CC1(C)C2CC3(c4c(cc(CCCCC)cc4OCO)OC3)C2C(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -15.434
InChIKey:SUQVLFQRQFVEGA-UHFFFAOYSA-N
ID: 89358
SMILES:c1(O)cc(CCCCC)cc2c1C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 89359
SMILES:C1CC2C(c3c(cc(CCCCC)cc3O)OC2(C)C)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 89360
SMILES:Oc1cc(CCCCC)c(O)c2c1C1=C(C(C)(C)O2)C=CC(C)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -14.702
InChIKey:AKOWGNYVWQJLEA-UHFFFAOYSA-N
ID: 89361
SMILES:C1(Cl)C2C(C)(O)CCC1(O)C(C)(C)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.955
CB1 binding score: -16.644
InChIKey:LUZQLYZSCQBPBY-UHFFFAOYSA-N
ID: 89362
SMILES:C1(Cc2c(O)cc(CCCCC)cc2O)C2(C)C(CC=C1C)C1(C)C(C(C)(C)C(=O)CC1)CC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.689
CB1 binding score: -14.572
InChIKey:HWRVIXOMKKVCRO-UHFFFAOYSA-N
ID: 89363
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(CC=C(CCC=C(C)C)C)(C(C)(C)C(O)C=C1)OC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.662
CB1 binding score: -15.321
InChIKey:SGZJXZCSROIHAE-UHFFFAOYSA-N
ID: 89364
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2CCC(C)=C3CCC(C)C3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -14.498
InChIKey:JCGKJLJIBWCCLH-UHFFFAOYSA-N
ID: 89365
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: 89366
SMILES:C(CCCC)c1cc(O)c(C2C=C(C(OC)=O)CCC2C(=C)C)c(C#CC(=C)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.565
CB1 binding score: -14.552
InChIKey:SVHDALPXSPOUTC-UHFFFAOYSA-N
ID: 89367
SMILES:C12(C)C(C3=CC(=O)OC4C(C)(C)Oc5cc(CCCCC)cc(c53)OC41)C(OC(=O)C)CC(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 498.616
CB1 binding score: -14.499
InChIKey:LSQUKJZVWVFEKS-UHFFFAOYSA-N
ID: 89368
SMILES:C1(C)=CCC2C(C)(C)Oc3c(c(O)cc(CCC)c3)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.805
InChIKey:CDBDULHNWQRYSY-UHFFFAOYSA-N
ID: 89369
SMILES:c1(OCCC(=C)C)c(CCCCC)c2c3c(c1)OC1(C)CC3C(CC1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -16.526
InChIKey:IJYOEJAETRKNNF-UHFFFAOYSA-N
ID: 89370
SMILES:c1(O)ccc(O)c2c1C1C(C(C)(C)O2)CCC(=C)C1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.332
CB1 binding score: -17.305
InChIKey:OEDIZYZBSHDLFB-UHFFFAOYSA-N
ID: 89371
SMILES:C(C)(=CC1C2C(C)(CCCC2(C)C)Oc2c1c(O)cc(CCCCC)c2OC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.668
CB1 binding score: -14.426
InChIKey:IYHMNSMBFWFIOY-UHFFFAOYSA-N
ID: 89372
SMILES:C12C(C1(C)C)C1CC(C)(Oc3c(c(O)cc(CCCCC)c3)C1)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -16.419
InChIKey:VXNOLECZYGTKJA-UHFFFAOYSA-N
ID: 89373
SMILES:c1(CCCCC)cc(O)c(C2C(C(=C)C)CC(O)C(=C)CC2)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -13.705
InChIKey:TVEGEEDQUPNIHX-UHFFFAOYSA-N
ID: 89374
SMILES:C1(Cc2c(O)cc(CCCCC)cc2O)=C(C)CCCC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.502
InChIKey:BXSAWMQNDRARAR-UHFFFAOYSA-N
ID: 89375
SMILES:C(C(c1cc2c(c(O)c1C)C1=C(C(C)(C)CCC1)C=CC(C)(C)O2)O)CC(=O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -15.743
InChIKey:QUHUDOVBDCBIHF-UHFFFAOYSA-N
ID: 89376
SMILES:CCCCCc1ccc(O)c(C2C=C(C)CCC2C(C)=C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.247
InChIKey:IJXLDZIYGDHKBA-UHFFFAOYSA-N