ID: 117328
SMILES:CC1=CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -18.334
InChIKey:JRPARYVCKDQCGY-UHFFFAOYSA-N
ID: 117329
SMILES:c1(OC2OC(CO)C(O)C(O)C2O)c2c(c(O)cc1CCCCC)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 492.609
CB1 binding score: -14.397
InChIKey:HUOJGDJZLGQLKL-UHFFFAOYSA-N
ID: 117330
SMILES:CC1=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 117331
SMILES:Oc1cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -18.218
InChIKey:UZWBOVFGUISXLX-UHFFFAOYSA-N
ID: 117332
SMILES:C(C)CCc1ccc2c(c1)OC(C)(C)c1ccc(C)cc1-2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 280.411
CB1 binding score: -16.474
InChIKey:FOHZBPFPXJJIHW-UHFFFAOYSA-N
ID: 117333
SMILES:CCC(C)=CC(C)C(c1cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -14.771
InChIKey:GNMUCUOHLJQTAG-UHFFFAOYSA-N
ID: 117334
SMILES:c1cc(C2C=C(C)CCC2C(C)=C)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -18.767
InChIKey:FFUBTKRHDZNPRU-UHFFFAOYSA-N
ID: 117335
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: 117336
SMILES:C(CCC)Cc1c(C(C(CC)C)=O)c(O)c(CC=C(C)C)c(O)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -15.788
InChIKey:MPGBLWRSQKANGD-UHFFFAOYSA-N
ID: 117337
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(C(C)(C)CC=C1C)CC(CC=C(C)C)C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.697
CB1 binding score: -15.526
InChIKey:YUJMOUSLFUZBDY-UHFFFAOYSA-N
ID: 117338
SMILES:C1CC2C(=C(C)C)CCC2(C)Oc2c(CC=C(C)C)c(O)cc(CCCCC)c21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -13.108
InChIKey:JLXLWGGITRXRNP-UHFFFAOYSA-N
ID: 117339
SMILES:O1c2cc(C)cc(O)c2C2=C(CCC2C)C1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -16.539
InChIKey:ZCFWFPZAQVWBPT-UHFFFAOYSA-N
ID: 117340
SMILES:C(=O)(CCc1ccc2c(c1)OC(C)(C)c1ccc(C)cc1-2)OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.393
CB1 binding score: -16.015
InChIKey:OVBQTEHTNFXUOA-UHFFFAOYSA-N
ID: 117341
SMILES:C1(O)C(C)(C)Oc2c(OC)c(CCCCC)cc(OC)c2C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 308.418
CB1 binding score: -16.914
InChIKey:PZISGCKZXKJXLZ-UHFFFAOYSA-N
ID: 117342
SMILES:CC(CCC1C(CCC=C(C)C)(C)C2CC(=O)C1c1cc(O)c(C)cc1O2)CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -13.628
InChIKey:RLASMFYTLFAKJR-UHFFFAOYSA-N
ID: 117343
SMILES:C1(C(C)(O)C)C(c2c(OC)cc(CCCCC)cc2O)C=C(C)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -17.334
InChIKey:OXNUFDAXQWXZBP-UHFFFAOYSA-N
ID: 117344
SMILES:OC1(C(C)C)C(c2c(O)cc(CCCCC)cc2O)CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -13.877
InChIKey:AEKCEPKXNNLCIF-UHFFFAOYSA-N
ID: 117345
SMILES:C1C(C)(O)C2C(c3c(O)cc(CCCCC)cc3OC(C)(C)C(O)C2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -16.223
InChIKey:UCOULNWYVAWGGX-UHFFFAOYSA-N
ID: 117346
SMILES:c12c(CC=C(C)C)cc(CCCC(C)C)cc1OC(C)(C)C(O)CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.593
CB1 binding score: -17.527
InChIKey:LZSFOAQGMHRDOY-UHFFFAOYSA-N
ID: 117347
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C1C1C=C(C)CCC1C(C)(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -16.608
InChIKey:FQILBSHXYWCPAM-UHFFFAOYSA-N
ID: 117348
SMILES:O=C1c2c(OC)cc(CCCCC)cc2OC1(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -17.81
InChIKey:HNWKMGXBZNCDAK-UHFFFAOYSA-N