ID: 35407
SMILES:C1(=O)OC2c3c(O)cc(CCCC)cc3OC(=O)C13CCC1C(C)(C)C3C12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.472
CB1 binding score: -16.515
InChIKey:QCSIWKVBWYBZTC-UHFFFAOYSA-N
ID: 35408
SMILES:C1(C)=CC2C(C)(C)Oc3c(c(O)cc(C(=O)C(CC)C)c3)C2CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -12.944
InChIKey:ZBLLBAHRCCYDDD-UHFFFAOYSA-N
ID: 35409
SMILES:c1(C2C(C(C)C)CCC(C)=C2)c(CCCCC)cc2c(c1O)OC(C)(C)C1C2C=C(C(=O)O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.689
CB1 binding score: -13.1
InChIKey:ZLNSAGTYRRPWLJ-UHFFFAOYSA-N
ID: 35410
SMILES:CC(C)=CCCC(C1CC=C(CCc2c(C)cc(O)cc2C)CC1)(O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -16.724
InChIKey:SBASORNFACRIMP-UHFFFAOYSA-N
ID: 35411
SMILES:C1(OC)C2(O)C(CC(C)=C1)c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.38
InChIKey:MVCGTUVXKGSRFI-UHFFFAOYSA-N
ID: 35412
SMILES:c1(O)c(C)c(O)cc2c1C1C(C(C)(C)O2)CCC(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -16.274
InChIKey:GEUAKOKGQTXRQU-UHFFFAOYSA-N
ID: 35413
SMILES:C1(C)=CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c31)CCC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.93
InChIKey:FZPPNPGAXWJGMQ-UHFFFAOYSA-N
ID: 35414
SMILES:CC(C)=CC12Oc3cc(CCCCC)cc(O)c3C(=O)C1CC(O)C(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -16.826
InChIKey:JKUCQIIYBVKEQM-UHFFFAOYSA-N
ID: 35415
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -19.729
InChIKey:GIIVGKMZIUKMMN-UHFFFAOYSA-N
ID: 35416
SMILES:C(C1Oc2c(c(O)cc(CCCCCC)c2)C2C1CC(O)C(CO)=C2)O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -13.091
InChIKey:SJAUVBVGVDKOIA-UHFFFAOYSA-N
ID: 35417
SMILES:O(C(C)=O)C(C)(C(OC(=O)c1ccccc1)C)C(=O)c1c(O)c2c(cc1OC)OC(C)(C)C1C2C=C(CCC=C(C)C)C(OC)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 634.766
CB1 binding score: -15.577
InChIKey:CLXUXHIMUOCPPB-UHFFFAOYSA-N
ID: 35418
SMILES:C1(C)(C)Oc2cc(CCCCC)cc(O)c2C2C=C1C(=O)C1C(O)(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: -13.906
InChIKey:BTSBNSSSGJEPDO-UHFFFAOYSA-N
ID: 35419
SMILES:C1(C)(C)Oc2cc(CCCCC)c(C(OC3CC(C)=CCC3)=O)c(C(O)=O)c2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -15.968
InChIKey:QWQYCAGANFGMCT-UHFFFAOYSA-N
ID: 35420
SMILES:CC1=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 35421
SMILES:CC1(C)C(CCC(C)=CCc2c(O)cc(CCCCC)cc2O)=C(C)CCC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -16.015
InChIKey:IPMUVSLFVDISBY-UHFFFAOYSA-N
ID: 35422
SMILES:CC(C1C(c2c(O)cc(CCCCC)cc2O)CC(C)=CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.27
InChIKey:WPJGAEFIBVPIDI-UHFFFAOYSA-N
ID: 35423
SMILES:C(C1C2c3c(cc(O)cc3C)OC(C)(C)C2CC1)(OC)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.359
CB1 binding score: -15.888
InChIKey:HMNOYOSULOIJJX-UHFFFAOYSA-N
ID: 35424
SMILES:C1(C(C)C)(O)CCC2(Oc3c(c(O)cc(CCCCC)c3)C(O)C2)C1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -14.605
InChIKey:JDLJNIWGMZBHIC-UHFFFAOYSA-N
ID: 35425
SMILES:C(C)(c1c(I)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.338
CB1 binding score: -15.404
InChIKey:IOIWILWLLPNLPU-UHFFFAOYSA-N
ID: 35426
SMILES:C1(C(C)C)C(c2c(O)cc(CCCCC)cc2O)CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.27
InChIKey:WPJGAEFIBVPIDI-UHFFFAOYSA-N
ID: 35427
SMILES:C12CCC(C)CC1c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -19.13
InChIKey:MFDMGSPYNZKQBC-UHFFFAOYSA-N