ID: 97588
SMILES:CC1=CCC2C(C1)c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 97589
SMILES:OC1C(O)C(Oc2c(CC=C(CCC=C(C)C)C)c(O)cc(CCC)c2)OC(CO)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.572
CB1 binding score: -17.101
InChIKey:PXCNIJDMZLYZGC-UHFFFAOYSA-N
ID: 97590
SMILES:c1(O)cc(CCCCC)cc2c1-c1ccccc1OC2(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.529
CB1 binding score: -14.778
InChIKey:OLAKFQRXJJQOOU-UHFFFAOYSA-N
ID: 97591
SMILES:C12(O)C=C(C)CC1c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.416
InChIKey:QVEKTDNNGKYJTN-UHFFFAOYSA-N
ID: 97592
SMILES:c12c(cc(C)cc1OC)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -16.335
InChIKey:VMBUQSKAAZBJSG-UHFFFAOYSA-N
ID: 97593
SMILES:Oc1c(C2C=C(C(=O)O)CCC2C(=C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.686
InChIKey:LQHAPFLIUQWVJR-UHFFFAOYSA-N
ID: 97594
SMILES:C(CCCC)c1c2c(cc(O)c1)C1=C(C(C)(C)O2)C(O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.335
InChIKey:BZKUEHOLCWVNGJ-UHFFFAOYSA-N
ID: 97595
SMILES:C1=C(C)CCC2C1c1c(cccc1)OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -18.438
InChIKey:CBEWCUWSPDDHMI-UHFFFAOYSA-N
ID: 97596
SMILES:C1C(C)CCC2=C1C(C)(C)Oc1c2c(O)cc(CCC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -15.754
InChIKey:CLGGMJVPIUGPSC-UHFFFAOYSA-N
ID: 97597
SMILES:c12c(O)cc(CCCC)cc1OC(C)(C)C1C2(O)OC2(C1)C(C)CC(=O)C(C(c1ccc(C)cc1)CC(=O)OC)=C2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 578.702
CB1 binding score: -18.444
InChIKey:UIBMZXNVBPVUCJ-UHFFFAOYSA-N
ID: 97598
SMILES:CC(Oc1c2c(cc(C)c1)OC(CCC)(C)CC2)CC(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.474
CB1 binding score: -16.308
InChIKey:XZZMKGYYKOUGFX-UHFFFAOYSA-N
ID: 97599
SMILES:c1(CCCCC)cc(O)c2c(c1O)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.334
InChIKey:AGCCFGXZUUPBIN-UHFFFAOYSA-N
ID: 97600
SMILES:C=CC1(C)CCC(C(C)=C)C(c2c(O)cc(CCCCC)cc2O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -16.735
InChIKey:FMARVNBHFUIUNJ-UHFFFAOYSA-N
ID: 97601
SMILES:C(CC1C(C)(C)Oc2c(cc(O)cc2CCO)C1)C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.419
CB1 binding score: -17.318
InChIKey:IAPAKTOJOGTHHU-UHFFFAOYSA-N
ID: 97602
SMILES:CC1=CC2C(C(C)(C)Oc3c(O)cc(CCCCCC)cc32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.575
InChIKey:NXPNWMQZZRHKHX-UHFFFAOYSA-N
ID: 97603
SMILES:C(CCCc1cc(O)c2c(c1)OC(C)(C)C1=C2C(C(C)C)CC1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.045
InChIKey:KSTHDIZKOSHAQF-UHFFFAOYSA-N
ID: 97604
SMILES:O=C(O)C1=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 97605
SMILES:C1CC2(c3c(O)cc(CCCCC)cc3OC2(C)C)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -17.69
InChIKey:MPYDMCXDBHAPAA-UHFFFAOYSA-N
ID: 97606
SMILES:c1c(C2CC=C(C=O)CC(C=C(C)CCC=C(C)C)O2)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -14.139
InChIKey:VXCWSCJBGKOCOF-UHFFFAOYSA-N
ID: 97607
SMILES:C12C=C(C)CC1c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.832
InChIKey:AFNHADXRZFCASY-UHFFFAOYSA-N
ID: 97608
SMILES:C(=CCC=C1C(=O)OC(C=C(C)CO)C1)C(C)=CCc1c(O)c(C)cc(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.472
CB1 binding score: -16.132
InChIKey:MTHLETRVGATPGQ-UHFFFAOYSA-N