ID: 113254
SMILES:C(c1cc(O)c(C2CCC(C)(C)OC2=O)c(O)c1)(C=C(C)C)CC(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -14.945
InChIKey:FLWLRHYVNGUIAW-UHFFFAOYSA-N
ID: 113255
SMILES:CC(C)(O)C1CCC(CO)(C)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.499
CB1 binding score: -14.99
InChIKey:BIOIOIFHBVFDEX-UHFFFAOYSA-N
ID: 113256
SMILES:C1(CC=C(C)C)(C(=C)CCc2cc(O)ccc2O)C(C=C)CC(O)C(C)(C)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -15.929
InChIKey:NWTLQWPKRPCFJM-UHFFFAOYSA-N
ID: 113257
SMILES:C(CCCC)c1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1CC=CC(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.599
CB1 binding score: -15.178
InChIKey:FJJMQSXDKWYWPL-UHFFFAOYSA-N
ID: 113258
SMILES:OC(C)(C)C1Cc2c(O)cc(CCCCCC)cc2OC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.473
CB1 binding score: -15.369
InChIKey:PTEHVQGODSWBBT-UHFFFAOYSA-N
ID: 113259
SMILES:O1c2cc(C)cc(O)c2C2C=C(C)CCC2C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -17.527
InChIKey:FMJNAKPTTHESLW-UHFFFAOYSA-N
ID: 113260
SMILES:C1(C)(C)C2(CC=C(C)CC2)c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.228
InChIKey:XQYSGOVDVJLJAU-UHFFFAOYSA-N
ID: 113261
SMILES:C1(Cc2c(O)ccc(O)c2)C(C(=C)C)CCC(=C)C1CCC(C)=CCO
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -16.879
InChIKey:HINRLMPWBVKUTP-UHFFFAOYSA-N
ID: 113262
SMILES:c12c(c(CCCCC)cc(OC)c1)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.095
InChIKey:CSEGJWMVHRXYBM-UHFFFAOYSA-N
ID: 113263
SMILES:CC(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 113264
SMILES:COc1c(OCC2C3CCC(C(C)C)C2C=C3C)c(O)cc(CCCCC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -15.137
InChIKey:RVLQSXXXPBDMCA-UHFFFAOYSA-N
ID: 113265
SMILES:C(c1cc(O)c(C2C(C(=C)C)CC(O)C(C)=C2)c(O)c1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.569
InChIKey:QZYQMFMYVWPRKQ-UHFFFAOYSA-N
ID: 113266
SMILES:C12C3C(C(C)C)C(OC3=O)CC1(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.462
InChIKey:PGKUOHWYGZEQOT-UHFFFAOYSA-N
ID: 113267
SMILES:C1(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 113268
SMILES:C(c1c(O)cc(C)c2c1CC(C)=CCC2)CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 230.351
CB1 binding score: Not available
InChIKey:OAZSEHOKMCPIRG-UHFFFAOYSA-N
ID: 113269
SMILES:O1c2c(c(O)cc(C)c2)C2CC(C)=CCC2C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.619
InChIKey:MMZAEMNNHWYQKW-UHFFFAOYSA-N
ID: 113270
SMILES:c1c(CCCCC)cc2c(c1O)C1CC(C)(O2)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.198
InChIKey:NUXUDGMVYZUFNQ-UHFFFAOYSA-N
ID: 113271
SMILES:O1c2c(c(O)cc(CCCCC)c2)C=CC1(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -20.081
InChIKey:XLSYFQOJMWXOCT-UHFFFAOYSA-N
ID: 113272
SMILES:O=C(C)ONC12C(CC(C)=CC1)c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 387.52
CB1 binding score: -12.295
InChIKey:MHEVDUVCQSMYPF-UHFFFAOYSA-N
ID: 113273
SMILES:CC(CC(OC1(C)CCCC2(C)C1C(=O)C=C(CC)C2c1ccc(OC)cc1OC)=O)CCCC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.677
CB1 binding score: -12.843
InChIKey:VBSIWBWTCOEEDS-UHFFFAOYSA-N
ID: 113274
SMILES:c1(O)cc(CCCCC)cc2c1C1C=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