ID: 65521
SMILES:c1(O)c(O)c2c(cc1CCC)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.87
InChIKey:LTLOXNKYTVLCCM-UHFFFAOYSA-N
ID: 65522
SMILES:CC(C)=CCc1c(O)c(CC=C(C)CCC=C(C)C)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.748
InChIKey:VRXKPPYOGGSRFK-UHFFFAOYSA-N
ID: 65523
SMILES:C1CC2(C)Oc3c(c(O)cc(CCCCC)c3)C3C2C(CC(O)C=C(C)C)(C)C3CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.706
CB1 binding score: -15.12
InChIKey:ZOAYYAOJOAJBOL-UHFFFAOYSA-N
ID: 65524
SMILES:C1(C=Cc2ccccc2)(O)C(C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.474
CB1 binding score: -15.941
InChIKey:NKFZOGKJMQPHEG-UHFFFAOYSA-N
ID: 65525
SMILES:C12C(C)(CCC=C(C)C)Oc3c(c(O)cc(CCCCC)c3O)C1CC(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -15.821
InChIKey:NUOSAXDCXXKPRC-UHFFFAOYSA-N
ID: 65526
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 65527
SMILES:c1(CCCCCC)c2c(O)c(CC=C(C)C)c(O)cc2OC2c3c(c12)C=CC(C)(C)O3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.565
CB1 binding score: -16.029
InChIKey:SPMDTPGFJZYFRB-UHFFFAOYSA-N
ID: 65528
SMILES:C1=C(C)CC2C(C(C)(C)Oc3c(C(=O)C(C)C)c(O)cc(O)c32)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -17.896
InChIKey:YAFMVAAAXLTYHW-UHFFFAOYSA-N
ID: 65529
SMILES:O1C(=O)C2=CC3C(C12)C(C)(C)Oc1cc(CCCCC)cc(O)c1C3=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.418
CB1 binding score: Not available
InChIKey:OPPUONJFKYFUTE-UHFFFAOYSA-N
ID: 65530
SMILES:C1(O)(C)CC2C(C(C)(C)Oc3c2c(O)ccc3)CC=C(C)CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -12.231
InChIKey:PDBFNXVICQZWIL-UHFFFAOYSA-N
ID: 65531
SMILES:CC(C1C(c2c(O)cc(CCCCC)cc2O)C(=O)C(C)=C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.19
InChIKey:NBPSYMBXWYDPRJ-UHFFFAOYSA-N
ID: 65532
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: 65533
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.487
CB1 binding score: -19.108
InChIKey:KCGRQTUOQYSEJY-UHFFFAOYSA-N
ID: 65534
SMILES:C1CC(C(C)=C)C(c2c(O)cc(CCCC)cc2O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.739
InChIKey:WBRXESQKGXYDOL-UHFFFAOYSA-N
ID: 65535
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 65536
SMILES:c1c(O)c2c(cc1CC)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -17.588
InChIKey:JZEQHRTZXSCBRS-UHFFFAOYSA-N
ID: 65537
SMILES:c1(C(OC)=O)c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -16.964
InChIKey:MBEBXVCEBIZPBC-UHFFFAOYSA-N
ID: 65538
SMILES:C1Oc2cc(CCCCC)cc(O)c2C1(O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 236.311
CB1 binding score: -17.354
InChIKey:ALQPEKUWYPLHQT-UHFFFAOYSA-N
ID: 65539
SMILES:c1(CCC)cc(O)cc2c1OC(C)(C)C1CCC(C)(O)C(O)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -16.249
InChIKey:UAYYCASURLZXHJ-UHFFFAOYSA-N
ID: 65540
SMILES:c1(CC=C(C)C)cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -19.034
InChIKey:SKFPSWUXWVYQEV-UHFFFAOYSA-N
ID: 65541
SMILES:c1(CCCCC)cc2c3c(c1O)CC1C(C)(O3)OC(C)(C)C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -9.199
InChIKey:FRZPCLMPKDTYIP-UHFFFAOYSA-N