ID: 108025
SMILES:c1(CC=C(CCC=C(C)C)C)c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 108026
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1=CC(=O)C3(CCC(C#CC(O)CCCCC)N(C)C3)C1(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 535.769
CB1 binding score: -12.402
InChIKey:BABFPPTZHTXEAF-UHFFFAOYSA-N
ID: 108027
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)CCC(NC(C(O)=O)CC(=O)OC)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 459.539
CB1 binding score: -14.605
InChIKey:CPDXLLHHVPRMPX-UHFFFAOYSA-N
ID: 108028
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 108029
SMILES:O1C(=O)c2c(O)cc(CCCCC)cc2OC1(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.321
CB1 binding score: -18.153
InChIKey:ZRXDWBHLDHDWJW-UHFFFAOYSA-N
ID: 108030
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(C)c1c-2cc(C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -18.225
InChIKey:XUERFRQVGLONMR-UHFFFAOYSA-N
ID: 108031
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: 108032
SMILES:C12=CC(C)CCC1C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.727
InChIKey:YLTWYAXWDLZZCU-UHFFFAOYSA-N
ID: 108033
SMILES:O(C1=C(CO)C(CC2c3c(cc(C)cc3O)OC2(C)C)C(C)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -16.059
InChIKey:NATCTZPQCWQGQS-UHFFFAOYSA-N
ID: 108034
SMILES:C1C(C)CC(c2c(O)cc(OC)cc2CCCC)C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -13.474
InChIKey:BPKPMLGDKRRUTI-UHFFFAOYSA-N
ID: 108035
SMILES:CC1=CC2C(C(C)(C)Oc3cc(CCC=CC)c(C=O)c(O)c3C2=O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.473
CB1 binding score: -15.756
InChIKey:RLFKXQHWOXYSJC-UHFFFAOYSA-N
ID: 108036
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 108037
SMILES:C(CC)c1cc(O)c(CC2C(C(=O)O)=CC=CC2)c(CC=C(C)C)c1CCCCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -15.116
InChIKey:BTYPROIGAVFLMY-UHFFFAOYSA-N
ID: 108038
SMILES:c1c2c(c(OC)c(OC)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -17.005
InChIKey:HAWXUIDXSKOKOA-UHFFFAOYSA-N
ID: 108039
SMILES:O=C(OC1C(C)(C)C2CC=C3C(=O)OC(Oc4ccc(CCCCC)cc4O3)C2C1O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.524
CB1 binding score: -15.706
InChIKey:JLJWIPRCGHUHNC-UHFFFAOYSA-N
ID: 108040
SMILES:CC1(C)C2CCC(C)=CC2c2cc(CCCCC)cc(O)c2C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.911
InChIKey:SNQBJQWMDGPAOP-UHFFFAOYSA-N
ID: 108041
SMILES:C1C2(C)Oc3c(c(O)cc(CCCCC(=O)O)c3)CC2C(C(C)(C)O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -15.929
InChIKey:WSYUOROHILPYBG-UHFFFAOYSA-N
ID: 108042
SMILES:C12(C(O)c3c(O)cc(CCCCC)cc3OC1(C)C)CC(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -14.732
InChIKey:GTNZQTAKSUPCCR-UHFFFAOYSA-N
ID: 108043
SMILES:C(C)(=CCCC(C)=CCc1c(O)cc(CCCCC)c(C(=O)O)c1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 108044
SMILES:C1=C(C)C(CC=C(C)C)c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -18.002
InChIKey:WGRLIDFQMMPIJI-UHFFFAOYSA-N
ID: 108045
SMILES:c1(O)c(C2C(C(=C)C)CCC(C)=C2)c(OC)cc(CCc2ccc(O)cc2)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.512
CB1 binding score: -17.568
InChIKey:IBCCEYLITPPYSY-UHFFFAOYSA-N