ID: 86500
SMILES:CC1=CC2c3c(cc(CCCCC)c(C(=O)O)c3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.351
InChIKey:UCONUSSAWGCZMV-UHFFFAOYSA-N
ID: 86501
SMILES:C1(C)(O)CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 86502
SMILES:c1(O)c(C2C(=C)CCC(C(C)C)C2)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.937
InChIKey:KRNLNALVRDOJEW-UHFFFAOYSA-N
ID: 86503
SMILES:C1C(=O)C2C(C)(C1C(C)C(Cl)Br)CC(=O)c1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 455.82
CB1 binding score: -16.519
InChIKey:XYDMALYYTKJNCT-UHFFFAOYSA-N
ID: 86504
SMILES:C1(C)=CCC2C(C)(O)Oc3c(c(O)cc(CCCCC)c3)C12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -13.506
InChIKey:UXHQKKKEMVSOHQ-UHFFFAOYSA-N
ID: 86505
SMILES:c1(OC)c(CCCCC)cc2c(c1O)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.792
InChIKey:VDKAKXBXSAFIMF-UHFFFAOYSA-N
ID: 86506
SMILES:CC(Cc1cc(O)c(C2CC(=C)CCC2C(=C)C)c(O)c1)CCCCC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -15.67
InChIKey:DOEHXSAFXHVPQT-UHFFFAOYSA-N
ID: 86507
SMILES:c1(O)c(CC=C(C)C)c(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.887
InChIKey:MGJXLEJRYNCZIV-UHFFFAOYSA-N
ID: 86508
SMILES:CC(C)CCCCCc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -15.358
InChIKey:MHTQVUDOUQLGDN-UHFFFAOYSA-N
ID: 86509
SMILES:C(OC)(=O)C1=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(OC(C)=O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.515
CB1 binding score: -16.251
InChIKey:HZDZUWPBHKXLFC-UHFFFAOYSA-N
ID: 86510
SMILES:C1C(O)C2C(C)(C)Oc3c(c(O)cc(CCCCO)c3)C2C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -16.572
InChIKey:LAZRGYORSNYINY-UHFFFAOYSA-N
ID: 86511
SMILES:C1(OC(=O)C)C2C(C)(C)CCCC2(COC(C)=O)c2c(OC(=O)CC)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 488.621
CB1 binding score: -16.502
InChIKey:VIOWIMXKEDGNMD-UHFFFAOYSA-N
ID: 86512
SMILES:c1(CCC)cc2c(c(O)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.805
InChIKey:CDBDULHNWQRYSY-UHFFFAOYSA-N
ID: 86513
SMILES:Oc1c2c(c(CC=C(C)CCC=C(CCC=C(C)C)C)c(O)c1)C1C(CCC(CO)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.689
CB1 binding score: -14.534
InChIKey:OFQDBZCDGOMBAC-UHFFFAOYSA-N
ID: 86514
SMILES:c1(O)cc2c(cc1)OC(C)(C)C1C(C=C(C)CC2)CC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.426
CB1 binding score: -16.527
InChIKey:QXFVYFURZWYVGO-UHFFFAOYSA-N
ID: 86515
SMILES:C1C(C)(C(CCC(O)(C)C)=O)Oc2cc(CCCCC)cc(O)c2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -15.197
InChIKey:WGURLLPQKWPQCU-UHFFFAOYSA-N
ID: 86516
SMILES:c1(O)cc(C)cc2c1OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.913
InChIKey:USHZBDBBZHEKPJ-UHFFFAOYSA-N
ID: 86517
SMILES:C(c1c(CCCCCC)cc2c(c1O)C1C(C(C)(C)O2)CCC(C)=C1)(CO)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -17.69
InChIKey:DVFZRKFFYGDNIP-UHFFFAOYSA-N
ID: 86518
SMILES:C(=O)(c1c2c(cc(C)c1)OC1(C)C=CCC(C)(C)C1C2)CC(CC)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -15.929
InChIKey:HHKRJYVCFVRUMZ-UHFFFAOYSA-N
ID: 86519
SMILES:CC(C1C(c2c(O)cc(CCCCC)cc2O)C(O)C2(C(OC)=O)C(C1)C(O)(C)CCC2C(=C)C)=CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 514.703
CB1 binding score: -15.29
InChIKey:DGLQDVGGZDSXGJ-UHFFFAOYSA-N
ID: 86520
SMILES:C1(C)=CC2c3c(O)cc(CCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N