ID: 116425
SMILES:C(C)(C(=O)c1c(O)c2c(cc1C)OC(C)(C)c1ccc(C)cc1-2)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.42
CB1 binding score: -17.711
InChIKey:GTUHPEKGZGLORH-UHFFFAOYSA-N
ID: 116426
SMILES:C12CCC(C)(C)Oc3cc(CCCCC)cc(O)c3C1C(C(C)=C)CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -16.28
InChIKey:FZACYQFWSRVYDF-UHFFFAOYSA-N
ID: 116427
SMILES:CC(C#Cc1c(O)cc(CCCCC)cc1O)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.88
InChIKey:ZUDOWQPPHHOEJG-UHFFFAOYSA-N
ID: 116428
SMILES:c1ccc(C(OC2(C)CCC3OC3(C)C)C23CCC(C)=CC3)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.047
InChIKey:YSXGTYDWJDJFHW-UHFFFAOYSA-N
ID: 116429
SMILES:c1(CCC(=O)C23C(=O)OC(C2=C(C)C)C3C)c(C)cc(Oc2cc(CCCCC)cc(O)c2)cc1C1(C)CCC(C)=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 584.797
CB1 binding score: -14.055
InChIKey:OHHPNYNVFKLICL-UHFFFAOYSA-N
ID: 116430
SMILES:C1(C(C)C)C(O)CC(CCCC(C)C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.608
CB1 binding score: -17.377
InChIKey:SLEZDLWLLAVIRM-UHFFFAOYSA-N
ID: 116431
SMILES:C1C(O)C2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C(C=C(C)C)OC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -16.016
InChIKey:NQKKPOFABFRYCO-UHFFFAOYSA-N
ID: 116432
SMILES:C1(C)(C)Oc2cc(CCCCC)cc(OC)c2C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.348
InChIKey:FJRQDVCLUUZSIG-UHFFFAOYSA-N
ID: 116433
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C=C2)CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 218.296
CB1 binding score: -17.978
InChIKey:CHBXMMKWGIOKEK-UHFFFAOYSA-N
ID: 116434
SMILES:COc1c(C2C(C(C)=C)CCC(C)=C2)c(O)cc(OC)c1C=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -14.768
InChIKey:OMENMXLZTWLHIL-UHFFFAOYSA-N
ID: 116435
SMILES:c1(O)c(CC=C(C)CCC=C(C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 116436
SMILES:C1C(C(=C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 116437
SMILES:CC1(C)Oc2cc(CCCCC)cc(OC)c2C2C(CC1)C(C)CCC2C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.631
CB1 binding score: -15.726
InChIKey:KLRHAMBFRZYGSE-UHFFFAOYSA-N
ID: 116438
SMILES:C(CCc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1)C(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.784
InChIKey:IXPVEDJXXIWGFV-UHFFFAOYSA-N
ID: 116439
SMILES:c1(CCC(=O)C)cc2c(c(O)c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -16.879
InChIKey:VREMTNOIPOJZQH-UHFFFAOYSA-N
ID: 116440
SMILES:C1(C)C(O)C=C2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -13.974
InChIKey:CHGDTXOWVPBOOP-UHFFFAOYSA-N
ID: 116441
SMILES:C(O)C1(C)C2C=C(C)C(Oc3cc(CCCCC)cc(Br)c3)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 379.338
CB1 binding score: -16.262
InChIKey:GXLHRHCNHYNGJV-UHFFFAOYSA-N
ID: 116442
SMILES:C1(C)(C)Oc2c(c(O)cc(C)c2)C2C1CCC1(C)OC1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -16.471
InChIKey:FJWPZWUHVBHHOM-UHFFFAOYSA-N
ID: 116443
SMILES:CC1(C)CC2c3c(c(CCCCC)ccc3O1)CC(O)C(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -14.347
InChIKey:GYWYSTOBUCCDOM-UHFFFAOYSA-N
ID: 116444
SMILES:c1(O)cc(CCCCC)cc2c1C1=C(CC(C)(C)OO1)C(C)(C)C(CC=C(C)C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -16.131
InChIKey:ZPGMUPZTHFYBCG-UHFFFAOYSA-N
ID: 116445
SMILES:C(C=C(C)C=C)C1(C)Oc2cc(C)cc(O)c2CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -17.023
InChIKey:FIQJJGIEAQJMOY-UHFFFAOYSA-N